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ASDI Inc.

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Profile: ASDI Inc. is a contract research organization offering chemistry, sample preparation, and materials management services, as well as pharmaceutical, analytical & purification services. Our wide range of services and problem solving capabilities enable pharmaceutical, biotechnical & academic sectors to accelerate their drug discovery & research processes. We enable discovery for the global research community through innovation and increased efficiencies. We provide materials management services for the pharmaceutical and biotechnology industries around the world. We offer various chemical products including 2-propylpyrrolidine, n,n-dimethyl-4-(pyrrolidin-2-yl)aniline, 2-pyrrolidin-2-yl-pyridine, 2-thiophen-2-yl-pyrrolidine, 2-phenylpyrrolidine, 4-pyrrolidin-2-yl-pyridine, 3-pyrrolidin-2-yl-pyridine, 2-tert-butylpyrrolidine, 2-benzylpyrrolidine, 2-(4-methoxyphenyl)pyrrolidine, 2-(4-chlorophenyl)pyrrolidine, 2-(3-chlorophenyl)pyrrolidine and 2-(2-bromophenyl)pyrrolidine. We offer a variety of products to support early drug discovery, including high-throughput screening (HTS) libraries, fragment libraries, reagents/building blocks, and reactive intermediates. All libraries may be weighed, solubilized, and plated in accordance with client screening requirements. Our custom synthesizing capabilities are designed to provide synthetic support to laboratories and allow focusing on research. We are equipped with a variety of purification options including crystallization, distillation, and column chromatography. While column chromatography is often avoided for large-scale work, we are equipped to purify even kilograms of material using this technique.

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• (R)-1-Phenyl-3-propanolamine
IUPAC Name: (3R)-3-amino-3-phenylpropan-1-ol | CAS Registry Number: 170564-98-4
Synonyms: (R)-3-amino-3-phenylpropan-1-ol, (3R)-3-Amino-3-Phenylpropan-1-Ol, (r)-beta-phenylalaninol, (r)-1-phenyl-3-propanolamine, (R)-3-Amino-3-phenyl-1-propanol, AG-E-19772, (R)-A-Phenylalaninol, PubChem13853, AC1Q4UAY, SureCN1953317, (r)-3-phenyl-beta-alaninol, KSC491Q5L, CTK3J1855, R-3-amino-3-phenylpropan-1-ol, MolPort-002-501-546, (S)-2-amino-3-phenylpropan-1-ol, ACT04410, (r)-3-amino-3-phenyl propan-1-ol, (r)-3-amino-3-phenyl-propan-1-ol, AKOS005146368

Molecular Formula: C9H13NOMolecular Weight: 151.205620 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: SEQXIQNPMQTBGN-SECBINFHSA-N

• (2,6-Dichlorophenylthio)acetic
IUPAC Name: 2-(2,6-dichlorophenyl)sulfanylacetate | CAS Registry Number: 21248-45-3
Synonyms: ZINC02169237, CID1810590

Molecular Formula: C8H5Cl2O2S-Molecular Weight: 236.095100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: URNRRSJGOOTQBO-UHFFFAOYSA-M

• 4-Bromobenzylamine hydrochloride
IUPAC Name: (4-bromophenyl)methanamine hydrochloride | CAS Registry Number: 26177-44-6
Synonyms: 205214_ALDRICH, EINECS 247-503-3, ST5406408

Molecular Formula: C7H9BrClNMolecular Weight: 222.510060 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: BVYUYDBWQMSOKM-UHFFFAOYSA-N

• 1,3-Benzothiazol-2-ylmethanol
IUPAC Name: 1,3-benzothiazol-2-ylmethanol | CAS Registry Number: 37859-42-0
Synonyms: 2-Benzothiazolemethanol, IFLab1_002000, NSC108227, CID268122, SBB003908, ZINC00158625, SDCCGMLS-0065936.P001, TL8002783

Molecular Formula: C8H7NOSMolecular Weight: 165.212280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: PQXMQZYDBQBWNL-UHFFFAOYSA-N

• 2-Amino-1,3,4-thiadiazole
IUPAC Name: 1,3,4-thiadiazol-2-amine | CAS Registry Number: 4005-51-0
Synonyms: Aminothiadiazole, Aminothiadazole, 2-Aminothiadiazole, ATDA, 1,3,4-Thiadiazol-2-amine, ADTA, A-TDA, 1,3,4-Thiadiazole, 2-amino, NCIMech_000679, NSC4728, C2H3N3S, FDA 0084, NSC 4728, TF 128, 1,3,4-Thiadiazole-2-ylamine, 258881_ALDRICH, 2-Amino-1-thia-3,4-diazole, NSC-4728, EINECS 223-657-7, 1,3,4-THIADIAZOLE, 2-AMINO-

Molecular Formula: C2H3N3SMolecular Weight: 101.130320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: QUKGLNCXGVWCJX-UHFFFAOYSA-N

• (2,4-Dimethyl-1,3-thiazol-5-yl)methanol
IUPAC Name: (2,4-dimethyl-1,3-thiazol-5-yl)methanol | CAS Registry Number: 50382-32-6
Synonyms: (2,4-dimethylthiazol-5-yl)methanol, (2,4-dimethyl-1,3-thiazol-5-yl)methanol, SBB054806, AG-F-69418, (2,4-Dimethyl-thiazol-5-yl)-methanol, (2,4-dimethyl-1,3-thiazol-5-yl)methan-1-ol, ZINC00158617, AC1MCQTV, PubChem15759, SureCN95057, AC1Q2OV8, CTK4J2547, MolPort-000-142-304, 5-Thiazolemethanol,2,4-dimethyl-, (2,4-dimethyl-5-thiazolyl)methanol, ANW-47179, STL214574, (dimethyl-1,3-thiazol-5-yl)methanol, AKOS005143006, MCULE-3363773760

Molecular Formula: C6H9NOSMolecular Weight: 143.206760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: BRQKYVQSAUQHNC-UHFFFAOYSA-N

• 4-Phenoxyphenylboronic acid
IUPAC Name: [4-(phenoxy)phenyl]boronic acid | CAS Registry Number: 51067-38-0
Synonyms: 480142_ALDRICH, [4-(phenoxy)phenyl]boronic acid, ALBB-006103, SBB003409, TE3078, TL800742126

Molecular Formula: C12H11BO3Molecular Weight: 214.024940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: KFXUHRXGLWUOJT-UHFFFAOYSA-N

• 1,4-dihydro-2-(methylthio)-4-oxo-5-pyrimidine-carboxylate acid ethyl ester
IUPAC Name: ethyl 2-methylsulfanyl-6-oxo-1H-pyrimidine-5-carboxylate | CAS Registry Number: 53554-29-3
Synonyms: NCIOpen2_007256, NSC43816, ZINC00179971, ZINC01686087, ST5403456, EU-0009282

Molecular Formula: C8H10N2O3SMolecular Weight: 214.241600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: HDIWKNXVBQPJCO-UHFFFAOYSA-N

• (R)-1,2,3,4-Tetrahydroisoquinolin-3-yl-methanol
IUPAC Name: [(3R)-1,2,3,4-tetrahydroisoquinolin-3-yl]methanol | CAS Registry Number: 62855-02-1
Synonyms: (3r)-1,2,3,4-tetrahydroisoquinolin-3-ylmethanol, (R)-(1,2,3,4-Tetrahydroisoquinolin-3-yl)methanol, AC1LF5RT, SureCN4738129, Oprea1_551380, KSC288Q9P, CHEMBL61490, AC1Q77R7, CTK1I8897, CHEBI:194437, MolPort-001-770-607, KST-1A2333, ACT01977, AR-1A4279, OR8104, ZINC19802513, AKOS015856165, AG-G-31619, AK-35913, BR-35913

Molecular Formula: C10H13NOMolecular Weight: 163.216320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: ZSKDXMLMMQFHGW-SNVBAGLBSA-N

• 3,4-Dimethylbenzyl alcohol
IUPAC Name: (3,4-dimethylphenyl)methanol | CAS Registry Number: 6966-10-5
Synonyms: 3,4-DIMETHYLBENZYL ALCOHOL, Benzenemethanol, 3,4-dimethyl-, 188794_ALDRICH, NSC18728, EINECS 230-175-0, ZINC01561828, TL 00645, AI3-21300, InChI=1/C9H12O/c1-7-3-4-9(6-10)5-8(7)2/h3-5,10H,6H2,1-2H

Molecular Formula: C9H12OMolecular Weight: 136.190980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: OKGZCXPDJKKZAP-UHFFFAOYSA-N

• (S)-(-)-5-Hydroxymethyl-2(5H)-furanone
IUPAC Name: (2S)-2-(hydroxymethyl)-2H-furan-5-one | CAS Registry Number: 78508-96-0
Synonyms: 346861_ALDRICH, 55675_FLUKA, ZINC02558002, CID10176122, (S)-(−)-5-Hydroxymethyl-2(5H)-furanone, InChI=1/C5H6O3/c6-3-4-1-2-5(7)8-4/h1-2,4,6H,3H

Molecular Formula: C5H6O3Molecular Weight: 114.099340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: AWNLUIGMHSSXHB-BYPYZUCNSA-N

• 1,2-Epoxy-5-hexene
IUPAC Name: 2-but-3-enyloxirane | CAS Registry Number: 10353-53-4
Synonyms: Diallyl monoxide, Diallyl monooxide, 3-Butenyloxirane, 2-(3-Butenyl)oxirane, Oxirane, 3-butenyl-, 5,6-Epoxyhex-1-ene, 1-Hexene, 5,6-epoxy-, CCRIS 3748, Oxirane, 3-butenyl- (9CI), 260347_ALDRICH, EINECS 233-771-9, BRN 0104509, LS-75553, 5-17-01-00199 (Beilstein Handbook Reference)

Molecular Formula: C6H10OMolecular Weight: 98.143000 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: MUUOUUYKIVSIAR-UHFFFAOYSA-N

• (5-Methyl-2-phenyl-2H-1,2,3-triazol-4-yl)methanol
IUPAC Name: (5-methyl-2-phenyltriazol-4-yl)methanol | CAS Registry Number: 13322-19-5
Synonyms: 2h-1,2,3-triazole-4-methanol, 5-methyl-2-phenyl-, ZINC00158830, AC1LBRW3, AC1Q2PWA, AC1Q4VAM, SureCN201295, CTK4B8421, MolPort-000-142-544, AR-1E1898, SBB090963, AKOS006227828, AG-J-01920, CC16209, RP03658, SDCCGMLS-0065990.P001, (5-methyl-2-phenyltriazol-4-yl)methanol, AK-58029, BP-11085, KB-02174, FT-0604822

Molecular Formula: C10H11N3OMolecular Weight: 189.213840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: VYHJVMFMRIGUFV-UHFFFAOYSA-N

• 1,3,5-Trimethyl-1H-pyrazol-4-amine
IUPAC Name: 1,3,5-trimethylpyrazol-4-amine | CAS Registry Number: 28466-21-9
Synonyms: 4-Amino-1,3,5-trimethylpyrazole, TOS-BB-1296, Pyrazole, 4-amino-1,3,5-trimethyl-, BRN 0110739, SBB006986, ZINC00159651, 1,3,5-trimethyl-1H-pyrazol-4-ylamine, LS-128041, 5-25-09-00512 (Beilstein Handbook Reference), AN-989/25109004

Molecular Formula: C6H11N3Molecular Weight: 125.171640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: SSDGMKHZMNTWLS-UHFFFAOYSA-N

• 2-Methylcyclopropanemethanol
IUPAC Name: (2-methylcyclopropyl)methanol | CAS Registry Number: 6077-72-1
Synonyms: Cyclopropanemethanol, 2-methyl-, 233811_ALDRICH, CID138655, ZINC02539258, 2-Methylcyclopropanemethanol, mixture of cis and trans

Molecular Formula: C5H10OMolecular Weight: 86.132300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: SHEINYPABNPRPM-UHFFFAOYSA-N

• 4-Aminopyridine-3-Methanol
IUPAC Name: (4-aminopyridin-3-yl)methanol | CAS Registry Number: 138116-34-4
Synonyms: AmbTiA57015, 4-Aminopyridine-3-methanol, (4-aminopyridin-3-yl)methanol, (4-Amino-pyridin-3-yl)-methanol, CID10796739, A57015

Molecular Formula: C6H8N2OMolecular Weight: 124.140520 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: WNBVEYMTVDMSFZ-UHFFFAOYSA-N

• (1-Methyl-1h-1,2,3-Benzotriazol-5-Yl)methanol
IUPAC Name: (1-methylbenzotriazol-5-yl)methanol | CAS Registry Number: 120321-72-4
Synonyms: 1-Methyl-1H-benzotriazole-5-methanol, (1-methyl-1H-benzo[d][1,2,3]triazol-5-yl)methanol, (1-Methyl-1H-1,2,3-Benzotriazol-5-Yl)Methanol, (1-methylbenzotriazol-5-yl)methanol, SBB067314, AG-D-44242, (1-methyl-5-benzotriazolyl)methanol, ZINC00158987, ACMC-1CCSS, AC1MCR1Y, AC1Q40FI, SureCN1939333, CTK0H3821, MolPort-000-142-693, ANW-47799, AKOS006228041, AC-4627, RP02303, SDCCGMLS-0066043.P001, (1-methylbenzotriazol-5-yl)methan-1-ol

Molecular Formula: C8H9N3OMolecular Weight: 163.176560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: HVLCKOBNGNRDPT-UHFFFAOYSA-N

• (8-Iodo-1-Naphthyl)methanol
IUPAC Name: (8-iodonaphthalen-1-yl)methanol | CAS Registry Number: 85864-84-2
Synonyms: (8-Iodo-1-Naphthyl)Methanol, (8-iodonaphthalen-1-yl)methanol, CDS1_000765, AC1MCWZZ, Maybridge1_005517, AC1Q7C2C, DivK1c_001805, 1-Naphthalenemethanol,8-iodo-, 8-Iodo-1-naphthalenemethanol;, CTK5F5846, HMS557C17, MolPort-000-352-405, NRB00699, ZINC00162132, AKOS002838715, AG-H-46225, FT-0604851

Molecular Formula: C11H9IOMolecular Weight: 284.093030 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: LEZXJGCBDJGUPN-UHFFFAOYSA-N

• (4-Methyl-Piperazin-1-Yl)-Acetic Acid
IUPAC Name: 2-(4-methylpiperazin-1-yl)acetic acid | CAS Registry Number: 54699-92-2
Synonyms: MLS000123118, BB_SC-2396, (4-Methyl-piperazin-1-yl)-acetic acid, BAS 03840590, CID2762732, 2-(4-Methylpiperazin-1-yl)acetic acid, SMR000123790

Molecular Formula: C7H14N2O2Molecular Weight: 158.198260 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: JCXZKUZXVQKENT-UHFFFAOYSA-N

• (8-Bromo-3,4-Dihydro-2h-1,5-Benzodioxepin-7-Yl)(Phenyl)Methanone
IUPAC Name: (7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-phenylmethanone | CAS Registry Number: 175136-38-6
Synonyms: (8-bromo-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)(phenyl)methanone, ZINC00134820, AC1LDWSI, Maybridge1_002280, CBMicro_021551, Oprea1_553689, Oprea1_567197, AC1Q259W, CTK4D5270, HMS547P14, MolPort-001-762-348, BTB12837, CCG-13437, STK375011, AKOS000605750, AG-E-24872, MCULE-2479468183, BAS 01293624, BIM-0021641.P001, KB-146058

Molecular Formula: C16H13BrO3Molecular Weight: 333.176620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: AECNFLAZVMSKTC-UHFFFAOYSA-N

• (R)-N-(2-Propyl)-1-Phenylethylamine Hydrochloride
IUPAC Name: N-(1-phenylethyl)propan-2-amine;hydrochloride | CAS Registry Number: 128593-72-6
Synonyms: (R)-N-ISOPROPYL-1-PHENYLETHYLAMINE HYDROCHLORIDE, ACMC-20aphm, ACMC-20apid, (R)-(+)-N-Isopropyl-1-phenylethylamine hydrochloride, (S)-(-)-N-Isopropyl-1-Phenylethylamine Hydrochloride, 116297-12-2

Molecular Formula: C11H18ClNMolecular Weight: 199.720320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: SVRDLWQPQZOASL-UHFFFAOYSA-N

• 1,3,3-Trimethylbicyclo[2.2.1]heptan-2-Amine Hydrochloride
IUPAC Name: (1R,4S)-2,2,4-trimethylbicyclo[2.2.1]heptan-3-amine;hydrochloride | CAS Registry Number: 301822-76-4
Synonyms: CTK8F2935, AKOS006344229, AB1004257

Molecular Formula: C10H20ClNMolecular Weight: 189.725500 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: DEVCAEXWLLEPQL-VMKQZJJLSA-N

• (S)-(-)-2-Oxo-1,5-Imidazolidinedicarboxylic Acid 1-Benzyl Ester
IUPAC Name: (4S)-2-oxo-3-phenylmethoxycarbonylimidazolidine-4-carboxylic acid | CAS Registry Number: 59760-01-9
Synonyms: (S)-(-)-2-Oxo-1,5-imidazolidinedicarboxylic acid 1-benzyl ester, (S)-3-((Benzyloxy)carbonyl)-2-oxoimidazolidine-4-carboxylic acid, (S)-(?)-1-Z-2-Oxo-5-imidazolidinecarboxylicacid, AC1LELJR, SureCN464281, AC1Q71BO, 392308_ALDRICH, CTK1G7759, MolPort-001-791-141, ALBB-015026, 2-Oxo-imidazolidine-1,5-dicarboxyli, ANW-73467, AKOS005174975, AG-G-13271, AK-61200, KB-211295, A8385, FT-0684252, I04-4161, (S)-3-(benzyloxycarbonyl)-2-oxoimidazolidine-4-carboxylic acid

Molecular Formula: C12H12N2O5Molecular Weight: 264.234080 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: AYSUEIZKNBGWGN-VIFPVBQESA-N

• (S)-(+)-2-Methylbutyric Anhydride
IUPAC Name: [(2S)-2-methylbutanoyl] (2S)-2-methylbutanoate | CAS Registry Number: 84131-91-9
Synonyms: (S)-(+)-2-Methylbutyric anhydride, AC1Q2C7U, AC1Q2C7V, 348562_ALDRICH, CTK5F1861, (S)-()-2-Methylbutyric anhydride, AKOS015913586, AG-H-36032, I14-45957, Butanoic acid,2-methyl-, 1,1'-anhydride, (2S,2'S)-

Molecular Formula: C10H18O3Molecular Weight: 186.248120 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: WRTPVONNQPWNRH-YUMQZZPRSA-N

• (S)-(-)-2-Amino-3-Methyl-1,1-Diphenyl-1-Butanol
IUPAC Name: (2S)-2-amino-3-methyl-1,1-diphenylbutan-1-ol | CAS Registry Number: 78603-95-9
Synonyms: S-2-Amino-3-methyl-1,1-diphenylbutan-1-ol, (S)-(-)-2-Amino-3-methyl-1,1-diphenyl-1-butanol, 1,1-Diphenyl-L-valinol, (S)-2-Amino-1,1-diphenyl-3-methyl-1-butanol, PubChem18189, AC1LGZ1L, SureCN607719, AC1Q1NR0, 551015_ALDRICH, CTK8E1537, MolPort-001-793-079, FD1202, AKOS004903158, AK-45090, KB-80459, AB1000794, W8459, (2S)-2-amino-3-methyl-1,1-diphenylbutan-1-ol, (S)-2-Amino-3-methyl-1,1-diphenyl-butan-1-ol, I14-13683

Molecular Formula: C17H21NOMolecular Weight: 255.354740 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: LNQVZZGGOZBOQS-INIZCTEOSA-N

• (S)-N-Benzyl-1-(1-Naphthyl)ethylamine Hydrochloride
IUPAC Name: N-benzyl-1-naphthalen-1-ylethanamine;hydrochloride | CAS Registry Number: 163831-66-1
Synonyms: ST51038373, SureCN607723, CTK8H1705, SBB002972, ((1S)-1-naphthylethyl)benzylamine, chloride, (R)-N-Benzyl-1-(1-naphthyl)ethylamine hydrochloride

Molecular Formula: C19H20ClNMolecular Weight: 297.821800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: KCLJDAVYFCDIDY-UHFFFAOYSA-N

• (4-Pyridylthio)acetic acid
IUPAC Name: 2-pyridin-4-ylsulfanylacetic acid | CAS Registry Number: 10351-19-6
Synonyms: 4-Pyridylthioacetic acid, 4-Pyridylmercaptoacetic acid, (4-Pyridinylthio)acetic acid, 183237_ALDRICH, Acetic acid, (4-pyridinylthio)-, .alpha.-(4-Pyridylthio)acetic acid, EINECS 233-765-6, ST5308562, TL8000152

Molecular Formula: C7H7NO2SMolecular Weight: 169.200980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: PGUPJAPHYIEKLT-UHFFFAOYSA-N

• (S)-(-)-2-Methyl-1-butanol
IUPAC Name: (2S)-2-methylbutan-1-ol | CAS Registry Number: 1565-80-6
Synonyms: Active amyl alcohol, Prim. active amyl alcohol, (S)-2-Methyl-1-butanol, (S)-2-Methylbutan-1-ol, (2S)-2-methyl-1-butanol, (2S)-2-methylbutan-1-ol, A83407_ALDRICH, D-2-METHYL-1-BUTANOL, 65979_FLUKA, 65980_FLUKA, CHEBI:50625, ZINC02040993, (S)-(−)-2-Methylbutanol, DL-2-METHYL-1-BUTANOL, PRACT, (S)-(−)-2-Methyl-1-butanol, 137-32-6

Molecular Formula: C5H12OMolecular Weight: 88.148180 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: QPRQEDXDYOZYLA-YFKPBYRVSA-N

• (2-Phenyl-1,3-thiazol-4-yl)methanol
IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methanol | CAS Registry Number: 23780-13-4
Synonyms: (2-phenyl-1,3-thiazol-4-yl)methanol, (2-phenylthiazol-4-yl)methanol, AG-E-69829, 4-(Hydroxymethyl)-2-phenyl-1,3-thiazole, ZINC00158874, AC1MCQZY, SureCN104951, 4-Thiazolemethanol,2-phenyl-, AC1Q7C40, (2-phenyl-4-thiazolyl)methanol, CTK4F2250, MolPort-000-142-576, (2-phenyl-thiazol-4-yl)-methanol, 2-PHENYL-4-THIAZOLEMETHANOL, SBB091311, AKOS000320871, 4-THIAZOLEMETHANOL, 2-PHENYL-, AB12184, CC18309, QC-6271

Molecular Formula: C10H9NOSMolecular Weight: 191.249560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: HNFDKPSDOQRBBX-UHFFFAOYSA-N

• 2-(2-Chloro-4-fluorophenyl)-N'-hydroxyethanimidamide
IUPAC Name: 2-(2-chloro-4-fluorophenyl)-N'-hydroxyethanimidamide | CAS Registry Number: 306937-33-7
Synonyms: 2-(2-chloro-4-fluorophenyl)-N'-hydroxyethanimidamide, SBB055294, 2-(2-chloro-4-fluorophenyl)-1-(hydroxyimino)ethylamine, AC1Q4UW0, MolPort-000-147-091, MolPort-004-314-657, CCG-50590, AKOS000152974, AKOS015850043, FT-0608442, ST50949926, A820564, SR-01000639953-1, I14-28299, (Z)-2-(2-chloro-4-fluorophenyl)-N'-hydroxyethenimidamide, 2-(2-chloranyl-4-fluoranyl-phenyl)-N'-oxidanyl-ethanimidamide

Molecular Formula: C8H8ClFN2OMolecular Weight: 202.613323 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: ZRXMHYFYQBAPGT-UHFFFAOYSA-N

• 4-(4'-Nmethylbenzamide)piperidine
IUPAC Name: N-methyl-4-piperidin-4-ylbenzamide | CAS Registry Number: 161610-09-9
Synonyms: 4-(4'-N-Methylbenzamide)piperidine, N-Methyl-4-piperidin-4-yl-benzamide, N-Methyl-4-(Piperidin-4-Yl)Benzamide, AC1Q40KT, SureCN4179238, CTK6I4231, MolPort-002-499-741, ANW-54640, AKOS015897878, AB16324, AG-B-37332, AK-46215, KB-34535, N-METHYL-4-(4-PIPERIDYL)BENZAMIDE, KB-259013, ST51051398, N-METHYL-4-(4-PIPERIDINYL)-BENZAMIDE, 4-(4-METHYLAMINOCARBONYLPHENYL)PIPERIDINE, BENZAMIDE, N-METHYL-4-(4-PIPERIDINYL)-, I12-0234

Molecular Formula: C13H18N2OMolecular Weight: 218.294820 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: MDCWPUNPTDQWBD-UHFFFAOYSA-N

• 3,4,5-Trimethoxybenzylamine
IUPAC Name: (3,4,5-trimethoxyphenyl)methanamine | CAS Registry Number: 18638-99-8
Synonyms: NCIOpen2_001669, 338931_ALDRICH, NSC101336, CID87736, EINECS 242-468-0, BBV-156958, Benzenemethanamine, 3,4,5-trimethoxy-, InChI=1/C10H15NO3/c1-12-8-4-7(6-11)5-9(13-2)10(8)14-3/h4-5H,6,11H2,1-3H

Molecular Formula: C10H15NO3Molecular Weight: 197.231000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: YUPUSBMJCFBHAP-UHFFFAOYSA-N

• 1-Bromo-5-(1,3-Dioxolan-2-Yl)thiophene
IUPAC Name: 2-(5-bromothiophen-2-yl)-1,3-dioxolane | CAS Registry Number: 52157-62-7
Synonyms: SureCN1680604, AC1Q251F, CTK1G3269, MolPort-001-791-332, AKOS016023236, AG-F-77457, 1,3-Dioxolane, 2-(5-bromo-2-thienyl)-, 2-(5-Bromothiophen-2-Yl)-1,3-Dioxolane, 1-BROMO-5-(1,3-DIOXOLAN-2-YL)THIOPHENE

Molecular Formula: C7H7BrO2SMolecular Weight: 235.098280 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: XBQREIMFJKOHEL-UHFFFAOYSA-N

• (7-Bromo-2,3-Dihydro-1,4-Benzodioxin-6-Yl)(2-Methoxyphenyl)methanone
IUPAC Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-(2-methoxyphenyl)methanone | CAS Registry Number: 175136-41-1
Synonyms: (7-Bromo-2,3-Dihydro-1,4-Benzodioxin-6-Yl)(2-Methoxyphenyl)Methanone, ZINC00134918, AC1LDWW3, AC1Q4EBN, Maybridge1_002238, Oprea1_037347, CTK4D5273, HMS547N16, MolPort-001-004-343, BTB12950, AKOS003592399, AG-E-24875, KB-62951, FT-0604842, I14-35325, 6-bromo-7-(2-methoxybenzoyl)-2,3-dihydro-1,4-benzodioxine, (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-(2-methoxyphenyl)methanone, Methanone,(7-bromo-2,3-dihydro-1,4-benzodioxin-6-yl)(2-methoxyphenyl)-, (7-BROMO-2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)(2-METHOXYPHENYL)METHANONE;(7-Bromo-2,3-dihydro-1,4-benzodioxine-6-yl)-(2-methoxyphenyl)methanone;4,5-ETHYLENEDIOXY-2-(2-METHOXYBENZOYL)BROMOBENZENE

Molecular Formula: C16H13BrO4Molecular Weight: 349.176020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: BHCZTJFCGPSSMC-UHFFFAOYSA-N

• 2,6-Dimethoxybenzylamine
IUPAC Name: (2,6-dimethoxyphenyl)methanamine | CAS Registry Number: 20781-22-0
Synonyms: (2,6-dimethoxyphenyl)methanamine, (2,6-dimethoxyphenyl)methylamine, SBB059502, AG-E-52556, PubChem7395, ACMC-20ao8b, 2, 6-Dimethoxybenzylamine, SureCN113737, AC1MCU19, AC1Q4E9Q, CTK4E5095, MolPort-000-146-860, Benzenemethanamine,2,6-dimethoxy-, AKOS000169408, MCULE-7040393538, AK113454, KB-83654, FT-0082140, FT-0601996, ST50408145

Molecular Formula: C9H13NO2Molecular Weight: 167.205020 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: XEKGMBAKVJAVAZ-UHFFFAOYSA-N

• (6-Fluoro-4h-1,3-Benzodioxin-8-Yl)Methylamine, 97
IUPAC Name: (6-fluoro-4H-1,3-benzodioxin-8-yl)methanamine | CAS Registry Number: 306934-88-3
Synonyms: (6-fluoro-4H-1,3-benzodioxin-8-yl)methylamine, (6-Fluoro-2,4-Dihydro-1,3-Benzodioxin-8-Yl)Methanamine, AC1MCWM7, AC1Q53TH, SureCN1467720, STOCK7S-08705, CTK4G5604, MolPort-001-774-057, SBB090032, STL146704, AKOS005720751, AG-F-01288, MCULE-8285818888, KB-146041, 4H-1,3-Benzodioxin-8-methanamine,6-fluoro-, (6-fluoro-4H-1,3-benzodioxin-8-yl)methanamine, [(6-Fluoro-4H-1,3-benzodioxin-8-yl)methyl]amine, 1-(6-fluoro-4H-1,3-benzodioxin-8-yl)methanamine, (6-fluoro-2H,4H-benzo[e]1,3-dioxan-8-yl)methylamine

Molecular Formula: C9H10FNO2Molecular Weight: 183.179603 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: JNFVSJNYOFOUDD-UHFFFAOYSA-N

• (7-Bromo-2,3-Dihydro-1,4-Benzodioxin-6-Yl)(4-Chlorophenyl)Methanone
IUPAC Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-(4-chlorophenyl)methanone | CAS Registry Number: 175136-39-7
Synonyms: ST51001313, ZINC01041995, AC1LOJKQ, Maybridge1_002150, AC1Q3IK7, Oprea1_784476, CTK4D5271, HMS547J16, MolPort-001-004-244, AKOS003592524, AG-E-24873, MCULE-3997469214, KB-146051, FT-0604844, I14-35327, 6-bromo-7-(4-chlorobenzoyl)-2,3-dihydro-1,4-benzodioxine, 7-bromo(2H,3H-benzo[e]1,4-dioxan-6-yl) 4-chlorophenyl ketone, (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-(4-chlorophenyl)methanone, Methanone,(7-bromo-2,3-dihydro-1,4-benzodioxin-6-yl)(4-chlorophenyl)-, (7-BROMO-2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)(4-CHLOROPHENYL)METHANONE;(7-Bromo-2,3-dihydro-1,4-benzodioxine-6-yl)-(4-chlorophenyl)methanone;2-(4-CHLOROBENZOYL)-4,5-ETHYLENEDIOXYBROMOBENZENE

Molecular Formula: C15H10BrClO3Molecular Weight: 353.595100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: CYBXDLDZMRBBBM-UHFFFAOYSA-N

• (Methylthio)Acetic Acid
IUPAC Name: 2-methylsulfanylacetic acid | CAS Registry Number: 2444-37-3
Synonyms: (Methylthio)acetic acid, S-Methylthioglycolate, 2-Methylthioacetic acid, Acetic acid, (methylthio)-, (Methylmercapto)acetic acid, 359483_ALDRICH, CHEBI:47870, CID75551, EINECS 219-483-6, NSC263480, NSC 263480, C03173, T5215415, MTG

Molecular Formula: C3H6O2SMolecular Weight: 106.143540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: HGTBAIVLETUVCG-UHFFFAOYSA-N

• 1,1,1-Trifluoro-2-Propanol
IUPAC Name: 1,1,1-trifluoropropan-2-ol | CAS Registry Number: 374-01-6
Synonyms: 1,1,1-Trifluoroisopropanol, 1,1,1-TRIFLUORO-2-PROPANOL, 1,1,1-Trifluoropropanol-2, NSC3637, 1,1,1-Trifluoropropan-2-ol, 2-Propanol, 1,1,1-trifluoro-, 1-Methyl-2,2,2-trifluoroethanol, 540323_ALDRICH, CID9774, NSC 3637, EINECS 206-773-2, InChI=1/C3H5F3O/c1-2(7)3(4,5)6/h2,7H,1H, 17556-48-8

Molecular Formula: C3H5F3OMolecular Weight: 114.066410 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: GILIYJDBJZWGBG-UHFFFAOYSA-N

• 3-Phenoxybenzylamine Hydrochloride
IUPAC Name: (3-phenoxyphenyl)methanamine;hydrochloride | CAS Registry Number: 376637-85-3
Synonyms: (3-Phenoxyphenyl)methylamine hydrochloride, 3-Phenoxybenzylamine hydrochloride, (3-Phenoxyphenyl)Methanamine Hydrochloride, AGN-PC-01LQQC, SureCN919885, CTK7E5767, MolPort-000-143-758, BB_SC-5818, 3-Phenoxy-benzylamine hydrochloride, 3PBA-0-1, (3-phenoxybenzyl)amine hydrochloride, AR1547, SBB098482, (3-phenoxyphenyl)methylamine, chloride, AKOS015848645, AG-A-04067, MCULE-4649087513, (3-PHENOXYPHENYL)METHYLAMINE HCL, KB-33108, KB-85080

Molecular Formula: C13H14ClNOMolecular Weight: 235.709360 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: WMFHUUKYIUOHRA-UHFFFAOYSA-N

• (R)-(+)-O-Acetylmandelic acid
IUPAC Name: (2R)-2-acetyloxy-2-phenylacetic acid | CAS Registry Number: 51019-43-3
Synonyms: (R)-(-)-alpha-Acetoxyphenylacetic acid, (-)-O-Acetyl-D-mandelic acid, (R)-(-)-a-Acetylmandelic acid, (R)-(-)-O-Acetylmandelic acid, (R)-alpha-Acetoxyphenylacetic acid, PubChem8063, AC1MBZQI, SureCN628737, KSC496E2L, 253030_ALDRICH, AC1Q1L88, CTK3J6225, MolPort-001-792-865, (R)-(-)-alpha-Acetylmandelic acid, (R)-2-Acetoxy-2-phenylacetic acid, ANW-43616, SBB064740, (R)-(-)-A-Acetoxyphenylacetic acid, AKOS015890145, (2R)-2-acetyloxy-2-phenylacetic acid

Molecular Formula: C10H10O4Molecular Weight: 194.184000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: OBCUSTCTKLTMBX-SECBINFHSA-N

• (R)-Glycidol
IUPAC Name: [(2R)-oxiran-2-yl]methanol | CAS Registry Number: 57044-25-4
Synonyms: (R)-Oxiranemethanol, R(+)-glycidol, (+)-Glycidol, (R)-()-Glycidol, (R)-(+)-Glycidol, (2R)-oxiran-2-ylmethanol, (R)-()-Oxirane-2-methanol, (R)-3-hydroxy-1,2-epoxypropane, 480819_ALDRICH, CHEBI:18664, c0082, ZINC00900548, (R)-(+)-2,3-Epoxy-1-propanol, TL8003674, InChI=1/C3H6O2/c4-1-3-2-5-3/h3-4H,1-2H, 556-52-5, 60456-23-7

Molecular Formula: C3H6O2Molecular Weight: 74.078540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CTKINSOISVBQLD-GSVOUGTGSA-N

• 4-Ethoxybenzyl alcohol
IUPAC Name: (4-ethoxyphenyl)methanol | CAS Registry Number: 6214-44-4
Synonyms: p-Ethoxybenzyl alcohol, Benzenemethanol, 4-ethoxy-, (4-Ethoxyphenyl)methanol, 190470_ALDRICH, ARONIS013449, 4-ETHOXY BENZYL ALCOHOL, ALD-N014479, CID80345, EINECS 228-283-8, NSC406713, ZINC00406941, AI3-05517, InChI=1/C9H12O2/c1-2-11-9-5-3-8(7-10)4-6-9/h3-6,10H,2,7H2,1H

Molecular Formula: C9H12O2Molecular Weight: 152.190380 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: UKFLLQIRBABMKF-UHFFFAOYSA-N

• 4-Fluorophenylhydrazine hydrochloride
IUPAC Name: (4-fluorophenyl)hydrazine hydrochloride | CAS Registry Number: 823-85-8
Synonyms: F14203_ALDRICH, p-FLUOROPHENYLHYDRAZINE HCL, EINECS 212-521-2, EINECS 254-990-6, BTB 08671, (4-Fluorophenyl)hydrazine hydrochloride, (4-Fluorophenyl)hydrazine monohydrochloride, TL8005449, 40594-35-2

Molecular Formula: C6H8ClFN2Molecular Weight: 162.592523 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: FEKUXLUOKFSMRO-UHFFFAOYSA-N

• (S)-2-Tetrahydrofuroic acid
IUPAC Name: (2S)-oxolane-2-carboxylic acid | CAS Registry Number: 87392-07-2
Synonyms: (S)-(-)-2-Tetrahydrofuroic Acid, (S)-(-)-Tetrahydro-2-furoic acid, (2S)-oxolane-2-carboxylic acid, (S)-(-)-2-Carboxytetrahydrofuroic acid, (S)-tetrahydro-2-furoic acid, (S)-(-)-Tetrahydrofuran-2-carboxylic Acid, AG-H-52599, TFB, 2-Furancarboxylic acid, tetrahydro-, PubChem5795, SureCN239908, AC1L9JY0, AC1Q71BL, UNII-0I2B46K2SJ, (-)-Tetrahydro-2-furoic acid, (2S)-2-oxolanecarboxylic acid, 527890_ALDRICH, CTK3J6635, MolPort-001-792-498, Tetrahydro-2-furoic acid, (-)-

Molecular Formula: C5H8O3Molecular Weight: 116.115220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: UJJLJRQIPMGXEZ-BYPYZUCNSA-N

• (2-Pyrimidylthio)acetic acid
IUPAC Name: 2-pyrimidin-2-ylsulfanylacetic acid | CAS Registry Number: 88768-45-0
Synonyms: MLS000774942, 275530_ALDRICH, (Pyrimidin-2-ylthio)acetic acid, 2-(Carboxymethylthio)-pyrimidine, Acetic acid, (2-pyrimidinylthio)-, EINECS 289-445-1, SMR000365589, ST5142922

Molecular Formula: C6H6N2O2SMolecular Weight: 170.189040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: NIEOYUNNKKAQKI-UHFFFAOYSA-N

• 2-Fluorobenzylamine
IUPAC Name: (2-fluorophenyl)methanamine | CAS Registry Number: 89-99-6
Synonyms: o-Fluorobenzylamine, Benzylamine, o-fluoro-, Benzenemethanamine, 2-fluoro-, 1-(2-fluorophenyl)methanamine, 162485_ALDRICH, Benzylamine, o-fluoro- (8CI), ALBB-006026, EINECS 201-957-9, NSC158270, NSC 158270, ST5411793, InChI=1/C7H8FN/c8-7-4-2-1-3-6(7)5-9/h1-4H,5,9H

Molecular Formula: C7H8FNMolecular Weight: 125.143523 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: LRFWYBZWRQWZIM-UHFFFAOYSA-N

• 4-Antipyrinecarboxaldehyde
IUPAC Name: 1,5-dimethyl-3-oxo-2-phenylpyrazole-4-carbaldehyde | CAS Registry Number: 950-81-2
Synonyms: Antipyraldehyde, Febranine, Antipyrinaldehyd, 4-Formylantipyrine, Antipyrine, 4-formyl-, MLS000720037, 123250_ALDRICH, NSC60408, EINECS 213-452-0, SBB000559, ZINC00119347, SMR000304566, 2,3-Dimethyl-5-oxo-1-phenyl-3-pyrazoline-4-carboxaldehyde, 1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carbaldehyde, 1H-Pyrazole-4-carboxaldehyde, 2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-, 2,3-Dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazole-4-carbaldehyde

Molecular Formula: C12H12N2O2Molecular Weight: 216.235880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: QFYZFYDOEJZMDX-UHFFFAOYSA-N

• 3,4-Dimethoxyphenylboronic Acid
IUPAC Name: (3,4-dimethoxyphenyl)boronic acid | CAS Registry Number: 122775-35-3
Synonyms: 3,4-Dimethoxyphenylboronic acid, 480118_ALDRICH, (3,4-dimethoxyphenyl)boronic acid, ALBB-006117, FS011456, ST5405684, TL8000609

Molecular Formula: C8H11BO4Molecular Weight: 181.981540 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: RCVDPBFUMYUKPB-UHFFFAOYSA-N

• 1,3-Dimethylpentylamine
IUPAC Name: 4-methylhexan-2-amine | CAS Registry Number: 105-41-9
Synonyms: Forthane, Forthan, Methylhexaneamine, 1,3-Dimethylamylamine, 4-Methyl-2-hexylamine, 2-Amino-4-methylhexane, 2-Hexanamine, 4-methyl-, PENTYLAMINE, 1,3-DIMETHYL-, C7H17N, NSC 1106, WLN: ZY & 1Y2, EINECS 203-296-1, NSC1106, 2-Hexanamine, 4-methyl- (9CI), BRN 1731697, AI3-16556, LS-102272, 4-04-00-00747 (Beilstein Handbook Reference)

Molecular Formula: C7H17NMolecular Weight: 115.216580 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: YAHRDLICUYEDAU-UHFFFAOYSA-N


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