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Profile: Shanghai Chemhere Co., Ltd. deals with lab reagent, fine chemicals and active pharmaceutical ingredients. We develop catalysts and key reagents for laboratories. Our chemicals are used in research institutes and universities. We also offer custom synthesis in both research and development scale.

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• 4-Acetylphenoxyacetic acid
IUPAC Name: 2-(4-acetylphenoxy)acetic acid | CAS Registry Number: 1878-81-5
Synonyms: (p-Acetylphenoxy)acetic acid, Acetic acid, (4-acetylphenoxy)-, 393819_ALDRICH, P-ACETYLPHENOXYACETIC ACID, NSC9356, AIDS017981, AIDS-017981, EINECS 217-524-2, AI3-15464, ST5407816

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

InChIKey: KMXZEXUYXUMHEQ-UHFFFAOYSA-N

• (S)-4-(4-Aminobenzyl)-1,3-oxazolidin-2-one
IUPAC Name: (4S)-4-[(4-aminophenyl)methyl]-1,3-oxazolidin-2-one | CAS Registry Number: 152305-23-2
Synonyms: (S)-4-(4-Aminobenzyl)-2(1H)-oxazolidinone, (S)-4-(4-Aminobenzyl)-2-oxazolidinone, (S)-4-(4-aminobenzyl)oxazolidin-2-one, (4S)-4-[(4-Aminophenyl)methyl]-2-oxazolidinone, (S)-4-(4-AMINO-BENZYL)-OXAZOLIDINE-2-ONE, (S)-4-(4-AMINOBENZYL)-1,3-OXAZOLIDIN-2-ONE, (4S)-4-[(4-aminophenyl)methyl]-1,3-oxazolidin-2-one, (S)-4-(4-Aminobenzyl)-1,3-oxozolidin-2-one, SBB070336, AG-D-99528, (S)-4-(4'-AMINOBENZYL)-1,3-OXAZOLIDIN-2-ONE, (4s)-(4-aminobenzyl)-2-oxazolidine-2-one, 340041-89-6, PubChem7548, AC1OFFG2, SureCN825617, ZTR 5, 658405_ALDRICH, Jsp002933, CTK4C7393

Molecular Formula: C10H12N2O2Molecular Weight: 192.214480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: WNAVSKJKDPLWBD-VIFPVBQESA-N

• 2-Methoxyphenylacetic acid methyl
IUPAC Name: methyl 2-(2-methoxyphenyl)acetate | CAS Registry Number: 27798-60-3
Synonyms: Ambap1129, Methyl o-methoxyphenylacetate, Methyl (2-methoxyphenyl)acetate, EINECS 248-662-1, NSC245109, Benzeneacetic acid, 2-methoxy-, methyl ester, Acetic acid, (o-methoxyphenyl)-, methyl ester

Molecular Formula: C10H12O3Molecular Weight: 180.200480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: BNQRSYFOIRGRKV-UHFFFAOYSA-N

• 3-Methylindan-1-one
IUPAC Name: 3-methyl-2,3-dihydroinden-1-one | CAS Registry Number: 6072-57-7
Synonyms: 3-Methyl-1-indanone, 3-Methylindanone, 1-Indanone, 3-methyl-, 391271_ALDRICH, NSC89554, 1H-Inden-1-one, 2,3-dihydro-3-methyl-, CID259560, JPV 00046, TL8003848

Molecular Formula: C10H10OMolecular Weight: 146.185800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: XVTQSYKCADSUHN-UHFFFAOYSA-N

• 1-(2-Fluoro-4-nitrophenyl)piperazine
IUPAC Name: 1-(2-fluoro-4-nitrophenyl)piperazine | CAS Registry Number: 154590-33-7
Synonyms: 1-(2-fluoro-4-nitrophenyl)piperazine, PIPERAZINE, 1-(2-FLUORO-4-NITROPHENYL)-, AC1MD3OJ, AGN-PC-0D3EFK, SureCN522009, Oprea1_171822, CTK4C8337, A1956/0082244, MolPort-000-155-770, (2-fluoro-4-nitrophenyl)piperazine, ANW-56172, SBB096816, STK666951, AKOS003261289, AB09281, AG-E-02580, MCULE-7243381894, RP05365, 1-(2-fluoro-4-nitro-phenyl)-piperazine, AK-33448

Molecular Formula: C10H12FN3O2Molecular Weight: 225.219583 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: ZILOTWJFFLIFMZ-UHFFFAOYSA-N

• 2-Phenyl-4-Methylimidazole
IUPAC Name: 5-methyl-2-phenyl-1H-imidazole | CAS Registry Number: 827-43-0
Synonyms: 2-Phenyl-4-methylimidazole, 4-Methyl-2-phenylimidazole, 4-Methyl-2-phenyl-1H-imidazole, 375365_ALDRICH, 1H-Imidazole, 4-methyl-2-phenyl-, EINECS 212-571-5, SBB003991, STK192082, ZINC04705523, AC-907/25014273

Molecular Formula: C10H10N2Molecular Weight: 158.199800 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: TYOXIFXYEIILLY-UHFFFAOYSA-N

• 4'5'-Dimethyl-2'-hydroxyacetophenone
IUPAC Name: 1-(2-hydroxy-4,5-dimethylphenyl)ethanone | CAS Registry Number: 36436-65-4
Synonyms: ZINC00938866, 2-Hydroxy-4,5-dimethylacetophenone, 2'-Hydroxy-4',5'-dimethylacetophenone, EINECS 253-035-0, CID118976, SBB016321

Molecular Formula: C10H12O2Molecular Weight: 164.201080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YXVSURZEXVMUAM-UHFFFAOYSA-N

• 4-Isopropyl Benzoic Acid
IUPAC Name: 4-propan-2-ylbenzoic acid | CAS Registry Number: 536-66-3
Synonyms: Cuminic acid, 4-Isopropylbenzoic acid, CUMIC ACID, p-Isopropylbenzoic acid, p-cumic acid, p-Cumate, Benzoic acid, p-isopropyl-, 4-(1-Methylethyl)benzoic acid, Benzoic acid, 4-(1-methylethyl)-, 4-(propan-2-yl)benzoic acid, 268402_ALDRICH, NSC 1907, CHEBI:28122, EINECS 208-642-5, NSC1907, AIDS018015, AIDS-018015, Benzoic acid, p-isopropyl- (8CI), NSC20083, BRN 1907514

Molecular Formula: C10H12O2Molecular Weight: 164.201080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CKMXAIVXVKGGFM-UHFFFAOYSA-N

• 3,4,5-Trimethoxybenzonitrile
IUPAC Name: 3,4,5-trimethoxybenzonitrile | CAS Registry Number: 1885-35-4
Synonyms: 2,4,5-Trimethoxybenzonitrile, 3,4,5-Trimethoxybenzenecarbonitrile, BENZONITRILE, 3,4,5-TRIMETHOXY-, 132160_ALDRICH, EINECS 217-550-4, NSC408924, AIDS166847, NSC 408924, AIDS-166847, CID15892, Benzonitrile, 3,4,5-tri-methoxy-, BRN 0979686, SBB007562, ZINC00388209, LS-38790, TL8001531, 4-10-00-02024 (Beilstein Handbook Reference), AE-641/00664033, InChI=1/C10H11NO3/c1-12-8-4-7(6-11)5-9(13-2)10(8)14-3/h4-5H,1-3H

Molecular Formula: C10H11NO3Molecular Weight: 193.199240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: OSBQUSPVORCDCU-UHFFFAOYSA-N

• 1-(4'-Sulphophenyl)-3-Methyl-5-Pyrazolone
IUPAC Name: 4-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzenesulfonic acid | CAS Registry Number: 89-36-1
Synonyms: Pyrazoline G, 134163_ALDRICH, NSC4752, NSC26429, EINECS 201-901-3, NSC 26429, 1-(4-Sulfophenyl)-3-methyl-5-pyrazolone, AI3-08532, 3-Methyl-1-(4-sulfophenyl)-2-pyrazolin-5-one, A2558/0108985, 4-(3-Methyl-5-oxo-2-pyrazolin-1-yl)-benzenesulfonic acid, 4-(3-Methyl-5-oxo-2-pyrazolin-1-yl)benzenesulfonic acid, 4-(3-Methyl-5-oxo-2-pyrazolin-1-yl)benzenesulphonic acid, Benzenesulfonic acid, 4-(4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-, Benzenesulfonic acid, p-(3-methyl-5-oxo-2-pyrazolin-1-yl)-, Benzenesulfonic acid, p-(3-methyl-5-oxo-2-pyrazolin-1-yl)- (8CI), 74583-53-2

Molecular Formula: C10H10N2O4SMolecular Weight: 254.262400 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: CWJQQASJVVAXKL-UHFFFAOYSA-N

• 4-N-Propylbenzaldehyde
IUPAC Name: 4-propylbenzaldehyde | CAS Registry Number: 28785-06-0
Synonyms: p-Propylbenzaldehyde, 4-Propylbenzaldehyde, 4-Propylbenzaldehyd, Benzaldehyde, 4-propyl-, Benzaldehyde, p-propyl-, 562882_ALDRICH, EINECS 249-221-6, BRN 2206736, ZINC02584250, LS-25153, 2-07-00-00246 (Beilstein Handbook Reference)

Molecular Formula: C10H12OMolecular Weight: 148.201680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: MAUCRURSQMOFGV-UHFFFAOYSA-N

• 4-(Morpholine-4-Sulfonyl)-Benzenesulfonyl Chloride
IUPAC Name: 4-morpholin-4-ylsulfonylbenzenesulfonyl chloride | CAS Registry Number: 465514-13-0
Synonyms: 4-(morpholine-4-sulfonyl)benzenesulfonyl chloride, 4-(morpholin-4-ylsulfonyl)benzenesulfonyl chloride, AC1MCWC4, AC1Q3VL2, 4-morpholin-4-ylsulfonylbenzenesulfonyl Chloride, CTK4I9447, MolPort-000-144-977, AKOS001054779, AG-F-59770, MCULE-5704794029, MO00516, QC-5471, KB-187610, FT-0616825, EN300-08977, 4-(morpholinosulfonyl)benzene-1-sulfonyl chloride, 4-(Morpholine-4-sulphonyl)-benzenesulphonyl chloride, T5833295

Molecular Formula: C10H12ClNO5S2Molecular Weight: 325.788980 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: ZZSBUDUHESWZJB-UHFFFAOYSA-N

• 2,3-Dihydro-2,2-dimethyl-7-benzofuranol
IUPAC Name: 2,2-dimethyl-3H-1-benzofuran-7-ol | CAS Registry Number: 1563-38-8
Synonyms: Carbofuran phenol, Carbofuranphenol, Carbofuran 7-phenol, Carbofuran-7-phenol, RCRA waste no. U367, HSDB 5839, 347256_ALDRICH, CCRIS 9206, CHEBI:38474, EINECS 216-350-4, 7-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, NIA 10272, AIDS170430, BB_NC-0467, AIDS-170430, ZINC03881547, 2,3-Dihydro-2,2-dimethylbenzofuran-7-ol, CID15278, 2,3-DIHYDRO-2,2-DIMETHYL-7-BENZOFURANOL, AI3-27488

Molecular Formula: C10H12O2Molecular Weight: 164.201080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: WJGPNUBJBMCRQH-UHFFFAOYSA-N

• 4-Nitro-L-phenylalanine Methyl Ester Hydrochloride
IUPAC Name: methyl (2S)-2-amino-3-(4-nitrophenyl)propanoate;hydrochloride | CAS Registry Number: 17193-40-7
Synonyms: L-4-Nitrophenylalanine methyl ester hydrochloride, L-4-Nitrophenylalaninemethylesterhydrochloride, Methyl 4-nitro-L-phenylalaninate hydrochloride, p-Nitrophenylalanine methyl ester hydrochloride, (S)-(+)-4-Nitrophenylalanine methyl ester hydrochloride, SureCN240404, KSC496M7L, H-Phe(4-NO2)-OMe.HCl, 658421_ALDRICH, Jsp003511, H-Phe(4'-NO2)-OMe HCl, CTK3J6675, MolPort-005-932-821, ACT04408, ANW-22543, AKOS015845829, AKOS015891210, AC-3475, AM83109, AK-49480

Molecular Formula: C10H13ClN2O4Molecular Weight: 260.674220 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: BTHMRXRBXYHLRA-FVGYRXGTSA-N

• 2-Bromo-2-methylpropiophenone
IUPAC Name: 2-bromo-2-methyl-1-phenylpropan-1-one | CAS Registry Number: 10409-54-8
Synonyms: 2-Bromoisobutyrophenone, .alpha.-Bromoisobutyrophenone, alpha-Bromoisobutyrophenone, B69204_ALDRICH, Phenyl 2-bromo-2-propyl ketone, EINECS 233-879-6, ZINC00153526

Molecular Formula: C10H11BrOMolecular Weight: 227.097740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: QMOSZSHTSOWPRX-UHFFFAOYSA-N

• 4-Amino Salicylic Acid Calcium Salt
IUPAC Name: calcium 4-amino-2-hydroxybenzoate | CAS Registry Number: 133-15-3
Synonyms: CALCIUM-P-AMINO SALICYLATE

Molecular Formula: C14H12CaN2O6Molecular Weight: 344.332880 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 8

InChIKey: XDWVNCOPMIEDJK-UHFFFAOYSA-L

• 2-Propoxybenzoic acid
IUPAC Name: 2-propoxybenzoate | CAS Registry Number: 2100-31-4
Synonyms: ZINC02572613, CID7021529

Molecular Formula: C10H11O3-Molecular Weight: 179.192540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: OXOWWPXTTOCKKU-UHFFFAOYSA-M

• 5-Methyl-2-phenyl-2H-1,2,3-triazole-4-carbohydrazide
IUPAC Name: 5-methyl-2-phenyltriazole-4-carbohydrazide | CAS Registry Number: 175135-03-2
Synonyms: 5-methyl-2-phenyl-2H-1,2,3-triazole-4-carbohydrazide, 5-methyl-2-phenyl-1,2,3-triazole-4-carbohydrazide, ZINC00152689, AC1MCOAX, Maybridge1_001203, MLS000833638, CTK0H3499, HMS544O15, MolPort-000-141-625, HMS2789N20, BTB03569, SBB095426, AKOS000114187, AG-E-24740, RP05041, KB-73599, SMR000457159, 5-methyl-2-phenyl-4-triazolecarbohydrazide, 5-methyl-2-phenyltriazole-4-carbohydrazide, BB 0246695

Molecular Formula: C10H11N5OMolecular Weight: 217.227240 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: MJJMGWDMMYKRMM-UHFFFAOYSA-N

• 1,4-Benzodioxan-6-yl methyl ketone
IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-7-yl)ethanone | CAS Registry Number: 2879-20-1
Synonyms: Maybridge1_002180, 6-Acetyl-1,4-benzodioxane, 179027_ALDRICH, ZINC03861306, ALBB-002993, CID76143, ZERO/009863, EINECS 220-726-3, SDCCGMLS-0065885.P001, EU-0000213, 1-(2,3-Dihydro-1,4-benzodioxin-6-yl)ethanone, Ethanone, 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-, A2271/0095736, InChI=1/C10H10O3/c1-7(11)8-2-3-9-10(6-8)13-5-4-12-9/h2-3,6H,4-5H2,1H

Molecular Formula: C10H10O3Molecular Weight: 178.184600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: HGVWMTAIIYNQSI-UHFFFAOYSA-N

• 6-Methylthiochroman-4-one
IUPAC Name: 6-methyl-2,3-dihydrothiochromen-4-one | CAS Registry Number: 6948-34-1
Synonyms: 630683_ALDRICH, NSC55761, 6-Methylbenzothiopyran-4(4H)-one, CID81380, EINECS 230-114-8, ST5410599, 2,3-Dihydro-6-methyl-4H-1-benzothiopyran-4-one

Molecular Formula: C10H10OSMolecular Weight: 178.250800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BYWVVMGBFKFYMY-UHFFFAOYSA-N

• 4-Hydroxybenzoic acid isopropyl ester
IUPAC Name: propan-2-yl 4-hydroxybenzoate | CAS Registry Number: 4191-73-5
Synonyms: Isopropylparaben, Isopropyl p-hydroxybenzoate, Isopropyl 4-hydroxybenzoate, Isopropyl-4-hydroxybenzoate, 1-Methylethyl 4-hydroxybenzoate, 1-Methylethyl-4-hydroxybenzoate, ARONIS013203, EINECS 224-069-3, p-Hydroxybenzoic acid isopropyl ester, p-Oxybenzoesaureisopropylester [German], BRN 2641564, ZINC00397766, 4-Hydroxybenzoic acid, 1-methylethyl ester, LS-37595, Benzoic acid, 4-hydroxy-, 1-methylethyl ester, ST5406923, BENZOIC ACID, p-HYDROXY-, ISOPROPYL ESTER, 4-10-00-00375 (Beilstein Handbook Reference), Benzoic acid, 4-hydroxy-, 1-methylethyl ester (9CI)

Molecular Formula: C10H12O3Molecular Weight: 180.200480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CMHMMKSPYOOVGI-UHFFFAOYSA-N

• 2,3-Diaminonaphthalene
IUPAC Name: naphthalene-2,3-diamine | CAS Registry Number: 771-97-1
Synonyms: 2,3-Naphthalenediamine, 2,3-Naphthylenediamine, D2757_SIAL, 88461_FLUKA, EINECS 212-241-0, NSC 62692, NSC62692, SBB000127, ZINC00134238, LS-170545, C026373, InChI=1/C10H10N2/c11-9-5-7-3-1-2-4-8(7)6-10(9)12/h1-6H,11-12H, DAN

Molecular Formula: C10H10N2Molecular Weight: 158.199800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: XTBLDMQMUSHDEN-UHFFFAOYSA-N

• 1,2,3,4-Tetrahydro-benzo[b]azepin-5-one
IUPAC Name: 1,2,3,4-tetrahydro-1-benzazepin-5-one | CAS Registry Number: 1127-74-8
Synonyms: NSC163836, ZINC04244951, 1,2,3,4-Tetrahydrobenzoazepine-5-one, TL80073553

Molecular Formula: C10H11NOMolecular Weight: 161.200440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: NKRKBYFBKLDCFB-UHFFFAOYSA-N

• 4-Propyl Benzoic Acid
IUPAC Name: 4-propylbenzoic acid | CAS Registry Number: 2438-05-3
Synonyms: 4-n-Propylbenzoic acid, 4-Propylbenzoic acid, p-n-Propyl benzoic acid, 332976_ALDRICH, NSC168993, SBB006558, NCGC00166226-01

Molecular Formula: C10H12O2Molecular Weight: 164.201080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: ATZHGRNFEFVDDJ-UHFFFAOYSA-N

• 4-(N-Ethyl-N-2-methanesulfonylaminoethyl)-2-methylphenylenediamine
IUPAC Name: N-[2-(4-amino-N-ethyl-3-methylanilino)ethyl]methanesulfonamide; N-[2-(4-amino-N-ethyl-3-methylanilino)ethyl]methanesulfonamide; sulfuric acid | CAS Registry Number: 25646-71-3
Synonyms: Kodak CD-3, CD III, CD 3, FCD 03, EINECS 247-161-5, CD 003, NSC 164932, LS-90070, N-(2-(4-Amino-N-ethyl-m-toluidino)ethyl)methanesulfonamide sulfate (2:3), N-(2-(4-Amino-N-ethyl-m-toluidino)ethyl)methanesulphonamide sesquisulphate, Methanesulfonamide, N-(2-((4-amino-3-methylphenyl)ethylamino)ethyl)-, sulfate (2:3), Methanesulfonamide, N-(2-(4-amino-N-ethyl-m-toluidino)ethyl)-, sulfate (2:3), Methanesulfonamide, N-[2-[(4-amino-3-methylphenyl)ethylamino]ethyl]-, sulfate (2:3), N-{2-[(4-amino-3-methylphenyl)(ethyl)amino]ethyl}methanesulfonamide sulfate (2:3), 161061-60-5, 92-09-1

Molecular Formula: C24H48N6O16S5Molecular Weight: 836.993520 [g/mol]
H-Bond Donor: 10H-Bond Acceptor: 22

InChIKey: NPDFXFLCEDDWEG-UHFFFAOYSA-N

• 1,2-Dimethylindole
IUPAC Name: 1,2-dimethylindole | CAS Registry Number: 875-79-6
Synonyms: Indole, 1,2-dimethyl-, N-Methyl-2-methylindole, 1,2-DIMETHYLINDOLE, 1,2-Dimethyl-1H-indole, 1H-Indole, 1,2-dimethyl-, D165603_ALDRICH, Indole, 1,2-dimethyl- (8CI), NSC62087, EINECS 212-877-9, NSC 62087, STK301478, ZINC01081266, 1H-Indole, 1,2-dimethyl- (9CI), D-5348, InChI=1/C10H11N/c1-8-7-9-5-3-4-6-10(9)11(8)2/h3-7H,1-2H

Molecular Formula: C10H11NMolecular Weight: 145.201040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BJMUOUXGBFNLSN-UHFFFAOYSA-N

• 1-Isopropyl-1H-1,2,3-benzotriazole-5-carboxylic acid
IUPAC Name: 1-propan-2-ylbenzotriazole-5-carboxylic acid | CAS Registry Number: 306935-41-1
Synonyms: 1-isopropyl-1h-1,2,3-benzotriazole-5-carboxylic acid, 1-Isopropylbenzotriazole-5-carboxylic acid, 1-propan-2-ylbenzotriazole-5-carboxylic acid, 1-Isopropyl-1,2,3-benzotriazole-5-carboxylic acid, SBB053479, 1-isopropyl-1h-benzo[d][1,2,3]triazole-5-carboxylic acid, 1-(methylethyl)benzotriazole-5-carboxylic acid, Maybridge1_005244, ACMC-1AKAU, ibc 293, SureCN839123, AC1MC65B, Oprea1_143042, CHEMBL381638, IBC293, CTK1C1524, HMS556G08, CHEBI:438242, MolPort-000-144-879, HMS3269G15

Molecular Formula: C10H11N3O2Molecular Weight: 205.213240 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: RUTVRAJKELSHCC-UHFFFAOYSA-N

• 4-Phenoxybutyryl Chloride
IUPAC Name: 4-phenoxybutanoyl chloride | CAS Registry Number: 5139-89-9
Synonyms: 4-Phenoxybutyryl chloride, CID78819, EINECS 225-903-9, ZINC02389461

Molecular Formula: C10H11ClO2Molecular Weight: 198.646140 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: SYLRFDTUTMLVNM-UHFFFAOYSA-N

• 3-Methyl-2-oxobutyric acid calcium salt
IUPAC Name: calcium 3-methyl-2-oxobutanoate | CAS Registry Number: 51828-94-5
Synonyms: EINECS 257-456-0, 3-Methyl-2-oxobuttersaeure calciumsalz, Calcium 3-methyl-2-oxobutyrate (1:2), 759-05-7

Molecular Formula: C10H14CaO6Molecular Weight: 270.292560 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: IMZGMVJQWNJKCI-UHFFFAOYSA-L

• 2-Fluoro-5-(trifluoromethoxy)benzylae
IUPAC Name: [2-fluoro-5-(trifluoromethyl)phenyl]methanamine | CAS Registry Number: 199296-61-2
Synonyms: JRD-0378, 2-Fluoro-5-(trifluoromethyl)benzylamine, ST5407112, [2-Fluoro-5-(trifluoromethyl)phenyl]methanamine

Molecular Formula: C8H7F4NMolecular Weight: 193.141493 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: WIQWADYBGSRGCF-UHFFFAOYSA-N

• 2,4-Dimethyl Acetophenone
IUPAC Name: 1-(2,4-dimethylphenyl)ethanone | CAS Registry Number: 89-74-7
Synonyms: Acetyl-m-xylene, 2,4-Dimethylacetophenone, 2',4'-Dimethylacetophenone, Acetophenone, 2',4'-dimethyl-, Ethanone, 1-(2,4-dimethylphenyl)-, D138207_ALDRICH, W238708_ALDRICH, FEMA No. 2387, 38871_FLUKA, Methyl 2,4-dimethylphenyl ketone, NSC15333, EINECS 201-935-9, 1-(2,4-DIMETHYLPHENYL)ETHANONE, NSC 15333, ZINC01706892, Acetophenone, 2',4'-dimethyl- (8CI), AI3-20801, ST5331351

Molecular Formula: C10H12OMolecular Weight: 148.201680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: HSDSKVWQTONQBJ-UHFFFAOYSA-N

• 4-N-butylphenylboronic Acid
IUPAC Name: (4-butylphenyl)boronic acid | CAS Registry Number: 145240-28-4
Synonyms: 4-Butylphenylboronic acid, 4-n-Butylphenylboronic acid, 4-Butylbenzeneboronic Acid, 4-Butylphenylboronicacid, (4-Butylphenyl)Boranediol, AG-D-89023, (4-butylphenyl)boronic Acid, PubChem18523, ACMC-209cue, AC1N2RDA, SureCN152142, AC1Q2VE3, AMTB386, 4-N-Butylphenylboronic acid,, KSC174K1F, 521493_ALDRICH, CHEMBL555064, Jsp002653, CTK0H4512, CHEBI:660042

Molecular Formula: C10H15BO2Molecular Weight: 178.035900 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: UGZUUTHZEATQAM-UHFFFAOYSA-N

• 2-Bromo-1-(2,4-dimethylphenyl)ethan-1-one
IUPAC Name: 2-bromo-1-(2,4-dimethylphenyl)ethanone | CAS Registry Number: 26346-85-0
Synonyms: 2-bromo-1-(2,4-dimethylphenyl)ethanone, 2-Bromo-1-(2,4-Dimethylphenyl)Ethan-1-One, 2,4-Dimethyl phenacyl bromide, ZINC02566208, PubChem16796, AC1Q2HWE, AC1M14DR, 2,4-Dimethylphenacyl bromide, KSC557O1L, CTK4F7715, MolPort-000-144-144, ACT00459, ANW-46305, QC-964, SBB080844, AKOS000210454, AG-E-82745, MCULE-6971495395, AK-86381, KB-68187

Molecular Formula: C10H11BrOMolecular Weight: 227.097740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: GSCCVWPVPFIRJP-UHFFFAOYSA-N

• 1-Anilionaphthalene-8-sulphonic acid magnesium salt
IUPAC Name: 8-(anilino)naphthalene-1-sulfonic acid | CAS Registry Number: 18108-68-4
Synonyms: Phenylperi acid, 2ans, Peri acid, phenyl-, N-Phenyl peri acid, ANSA, 1ow4, 8-Anilino-1-naphthalenesulfonic acid, CBMicro_015520, 1-Anilino-8-naphthalenesulfonate, Anilinonaphthalenesulfonic acid, 1-anilino-8-naphthalene sulfonate, 1-Anilino-8-napthalenesulfonate, MLS001066405, 1-Aniline-8-naphthalene sulfonate, 1-Anilino-8-naphthalenesulfonic acid, A1028_SIAL, 8-Anilinonaphthalene-1-sulfonate, CHEBI:39708, NSC1746, 8-Anilinonaphthalene-1-sulphonic acid

Molecular Formula: C16H13NO3SMolecular Weight: 299.344320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: FWEOQOXTVHGIFQ-UHFFFAOYSA-N

• 1-Acetyl-5-nitroindoline
IUPAC Name: 1-(5-nitro-2,3-dihydroindol-1-yl)ethanone | CAS Registry Number: 33632-27-8
Synonyms: Maybridge1_006268, NCIOpen2_005414, Oprea1_261451, INDOLINE, 1-ACETYL-5-NITRO-, CCRIS 6767, EINECS 251-609-5, NSC 87626, 1H-Indole, 1-acetyl-2,3-dihydro-5-nitro-, NSC87626, BRN 0217294, ZINC04015944, LS-83443, ST013851, EU-0069230, 5-20-06-00253 (Beilstein Handbook Reference), InChI=1/C10H10N2O3/c1-7(13)11-5-4-8-6-9(12(14)15)2-3-10(8)11/h2-3,6H,4-5H2,1H

Molecular Formula: C10H10N2O3Molecular Weight: 206.198000 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: OJKKTNFCWMBYMT-UHFFFAOYSA-N

• (r)-2-hydroxy-4-phenylbutanoic Acid
IUPAC Name: (2R)-2-hydroxy-4-phenylbutanoic acid | CAS Registry Number: 29678-81-7
Synonyms: 420085_ALDRICH, 2-Hydroxy-4-phenylbutyric acid, (R)-2-Hydroxy-4-phenylbutyric acid, TL8002311, N-1121

Molecular Formula: C10H12O3Molecular Weight: 180.200480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: JNJCEALGCZSIGB-SECBINFHSA-N

• 1,2,3,4-Tetrahydro-2-naphthalenone
IUPAC Name: 3,4-dihydro-1H-naphthalen-2-one | CAS Registry Number: 530-93-8
Synonyms: beta-Tetralone, .beta.-Tetralone, 2-Tetralone, tetralin-2-one, dihydro-naphthalenone, 4e, 3,4-Dihydro-2-naphthol, 2(1H)-Naphthalenone, 3,4-dihydro-, NCIOpen2_001186, T19208_ALDRICH, 3,4-Dihydro-2(1H)naphthalenone, 3,4-dihydronaphthalen-2(1H)-one, 3,4-Dihydro-2(1H)-naphthalenone, CID68266, NSC87083, EINECS 208-498-3, NSC 87083, ZINC04203404, 1,2,3,4-Tetrahydronaphthalen-2-one, AI3-12003, InChI=1/C10H10O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-4H,5-7H

Molecular Formula: C10H10OMolecular Weight: 146.185800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: KCKZIWSINLBROE-UHFFFAOYSA-N

• 2-(4-Chlorophenoxy)-2-MethylPropionic Acid
IUPAC Name: 2-(4-chlorophenoxy)-2-methylpropanoic acid | CAS Registry Number: 882-09-7
Synonyms: clofibric acid, Clofibrin, Regulipid, Regadrin, Chlorfibrinic acid, Clofibrinic acid, Chlorofibrinic acid, Chlorophibrinic acid, Clofibrate free acid, Clofibrinsaeure, PCIB, PCPIB, Clofibrate Acid, Acidum chlorphibricum, CPIB, Prestwick_39, 4-CPIB, Clofibrinsaeure [German], Clofibric acid (INN), Spectrum_000160

Molecular Formula: C10H11ClO3Molecular Weight: 214.645540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: TXCGAZHTZHNUAI-UHFFFAOYSA-N

• 3-Benzoylpropionic Acid
IUPAC Name: 4-oxo-4-phenylbutanoic acid | CAS Registry Number: 2051-95-8
Synonyms: 3-Benzoylpropionic acid, 3-Benzoylpropanoic acid, beta-Benzoylpropionic acid, 4-Oxo-4-phenylbutyric acid, Propanoic acid, 3-benzoyl-, Propionic acid, 3-benzoyl-, 4-Oxo-4-phenylbutanoic acid, ChemDiv3_013347, .beta.-Benzoylpropionic acid, B13802_ALDRICH, Benzenebutanoic acid, .gamma.-oxo-, Benzenebutanoic acid, gamma-oxo-, NSC2092, AIDS017960, AIDS-017960, NSC 2092, NSC51010, EINECS 218-135-0, Propionic acid, 3-benzoyl- (8CI), NSC 51010

Molecular Formula: C10H10O3Molecular Weight: 178.184600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: KMQLIDDEQAJAGJ-UHFFFAOYSA-N

• 1-Benzylimidazole
IUPAC Name: 1-(phenylmethyl)imidazole | CAS Registry Number: 4238-71-5
Synonyms: 1-Benzyl-1H-imidazole, N-Benzylimidazole, Imidazole, 1-benzyl-, 2afx, 1H-Imidazole, 1-(phenylmethyl)-, Maybridge3_003880, 1-(phenylmethyl)imidazole, 1-BENZYL IMIDAZOLE, CCRIS 5821, MLS000069473, 116416_ALDRICH, Imidazole, 1-benzyl- (8CI), 13479_FLUKA, EINECS 224-200-4, NSC 126828, NSC 217337, NSC126828, NSC217337, SBB003990, ZINC00169811

Molecular Formula: C10H10N2Molecular Weight: 158.199800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: KKKDZZRICRFGSD-UHFFFAOYSA-N

• 4-(Nicotinamido)butanoic acid
IUPAC Name: 4-(pyridine-3-carbonylamino)butanoic acid | CAS Registry Number: 34562-97-5
Synonyms: Pikamilon, Nicotinoyl-GABA, GABA-NG, CBKinase1_003003, CBKinase1_015403, ZERO/000614, BAS 01153193, Butanoic acid, 4-((3-pyridinylcarbonyl)amino)-, LS-186820, LS-187486, EU-0052131, 4-[(Pyridine-3-carbonyl)-amino]-butyric acid

Molecular Formula: C10H12N2O3Molecular Weight: 208.213880 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: NAJVRARAUNYNDX-UHFFFAOYSA-N

• 2,3-Dimethylindole
IUPAC Name: 2,3-dimethyl-1H-indole | CAS Registry Number: 91-55-4
Synonyms: 1H-Indole, 2,3-dimethyl-, 2,3-Dimethyl-1H-indole, INDOLE, 2,3-DIMETHYL-, 120812_ALDRICH, EINECS 202-076-2, 2,3-DIMETHYLINDOLE, TECH, NSC 24936, NSC24936, ZINC01081072, LS-82921, ST5308004, D-5350, InChI=1/C10H11N/c1-7-8(2)11-10-6-4-3-5-9(7)10/h3-6,11H,1-2H

Molecular Formula: C10H11NMolecular Weight: 145.201040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: PYFVEIDRTLBMHG-UHFFFAOYSA-N

• 5-Methyl-2-phenyl-2H-1,2,3-triazole-4-carboxamide
IUPAC Name: 5-methyl-2-phenyltriazole-4-carboxamide | CAS Registry Number: 36401-53-3
Synonyms: 5-methyl-2-phenyl-2H-1,2,3-triazole-4-carboxamide, 5-methyl-2-phenyl-1,2,3-triazole-4-carboxamide, ZINC00152692, AC1MCOB5, Maybridge1_001029, SureCN5010589, MLS000833640, CTK4H6402, HMS544G17, MolPort-000-141-627, HMS2776F15, BTB03582, AKOS000114227, AG-F-26785, RP04366, SDCCGMLS-0065845.P001, 5-methyl-2-phenyl-4-triazolecarboxamide, 5-methyl-2-phenyltriazole-4-carboxamide, KB-43722, SMR000457161

Molecular Formula: C10H10N4OMolecular Weight: 202.212600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: IHPOVUXVIZRYAC-UHFFFAOYSA-N

• 5-Methyl-3-Phenyl-4-Isoxazolamine
IUPAC Name: 5-methyl-3-phenyl-1,2-oxazol-4-amine | CAS Registry Number: 21169-65-3
Synonyms: 5-methyl-3-phenyl-1,2-oxazol-4-amine, ZINC00129012, AC1MCN1F, AC1Q2FIY, Maybridge3_007577, SureCN657826, CTK4E6003, MolPort-000-147-095, HMS1452L15, 5-Methyl-3-phenylisoxazol-4-amine, 4-Amino-5-methyl-3-phenylisoxazole, 4-Isoxazolamine,5-methyl-3-phenyl-, CCG-55506, SBB088916, 5-methyl-3-phenylisoxazole-4-ylamine, AKOS006229432, AG-E-55299, TL01028, IDI1_018964, KB-73606

Molecular Formula: C10H10N2OMolecular Weight: 174.199200 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: QWMOVJWPTZATFS-UHFFFAOYSA-N

• 2-Isopropylphenyl isocyanate
IUPAC Name: 1-isocyanato-2-propan-2-ylbenzene | CAS Registry Number: 56309-56-9
Synonyms: o-Isopropylphenyl isocyanate, 478989_ALDRICH, 2-ISOPROPYLPHENYLISOCYANATE, EINECS 260-105-4, ZINC02560432

Molecular Formula: C10H11NOMolecular Weight: 161.200440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MWBSQVPLYJZPTG-UHFFFAOYSA-N

• 3-(2-Methylphenyl)propionic acid
IUPAC Name: 3-(2-methylphenyl)propanoic acid | CAS Registry Number: 22084-89-5
Synonyms: 2-Methylhydrocinnamic acid, 3-[2-Methylphenyl]propionic acid, 433330_ALDRICH, 3-(2-Methylphenyl)propanoic acid, CID30938, BBV-089851, 2-METHYL-BETA-PHENYLPROPANOIC ACID

Molecular Formula: C10H12O2Molecular Weight: 164.201080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: JIRKNEAMPYVPTD-UHFFFAOYSA-N

• 4-Methoxy Phenyl Propionic Acid
IUPAC Name: 3-(4-methylphenoxy)propanoic acid | CAS Registry Number: 25173-37-9
Synonyms: ChemDiv2_001074, p-Methoxyhydrocinnamic acid, MLS001002938, 3-(p-Methoxyphenyl)propionic acid, 548863_ALDRICH, IFLab1_006148, IFLab2_000178, 3-(4-Methylphenoxy)propionic acid, Propanoic acid, 3-(4-methylphenoxy)-, NSC134095, IDI1_019204, SMR000372578, EU-0014129, A3762/0159559

Molecular Formula: C10H12O3Molecular Weight: 180.200480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: GNPISAHACGIXLZ-UHFFFAOYSA-N

• (R)-Benzyloxymethyl-oxirane
IUPAC Name: (2R)-2-(phenylmethoxymethyl)oxirane | CAS Registry Number: 14618-80-5
Synonyms: (R)-O-Benzylglycidol, (R)-Benzyl glycidyl ether, R- Benzyloxymethyl-oxirane, CCRIS 6385, (R)-(-)-Benzyloxymethyloxirane, 363529_ALDRICH, (S)-1-(Benzyloxy)-2,3-epoxypropane, BRN 3588399, ZINC02170164, NCGC00166044-01, (−)-Benzyl (R)-glycidyl ether, Propane, 1-(benzyloxy)-2,3-epoxy-, (S)-, Oxirane, ((phenylmethoxy)methyl)-, (R)-, LS-119621, ST5405570, TL8001018, Propane, 1-(benzyloxy)-2,3-epoxy-, (R)-, (R)-(−)-2-(Benzyloxymethyl)oxirane, 5-17-03-00016 (Beilstein Handbook Reference), Oxirane, ((phenylmethoxy)methyl)-, (R)- (9CI)

Molecular Formula: C10H12O2Molecular Weight: 164.201080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: QNYBOILAKBSWFG-JTQLQIEISA-N

• 4-Propoxybenzaldehyde
IUPAC Name: 4-propoxybenzaldehyde | CAS Registry Number: 5736-85-6
Synonyms: p-Propoxybenzaldehyde, Propoxybenzaldehyde, Benzaldehyde, p-propoxy-, Benzaldehyde, 4-propoxy-, p-(n-Propoxy)benzaldehyde, WLN: VHR DO3, NSC 32509, 333638_ALDRICH, MolPort-000-158-383, NSC 406729, ALBB-007503, CID79812, NSC32509, BRN 0743408, NSC406729, STK500953, ZINC01664925, AI3-05518, FR-1083, LS-25152

Molecular Formula: C10H12O2Molecular Weight: 164.201080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: FGXZWMCBNMMYPL-UHFFFAOYSA-N

• 3-Phenyl Propanoic Acid Methyl Ester
IUPAC Name: methyl 3-phenylpropanoate | CAS Registry Number: 103-25-3
Synonyms: Methyl hydrocinnamate, Methyl 3-phenylpropanoate, Methyl dihydrocinnamate, Methyl 3-phenylpropionate, Methyl benzenepropanoate, Hydrocinnamic acid, methyl ester, Benzenepropanoic acid, methyl ester, Methyl beta-phenylpropionate, METHYL PHENYLPROPIONATE, Methyl .beta.-phenylpropionate, FEMA No. 2741, CID7643, NSC10128, EINECS 203-092-2, .beta.-Phenylpropionic acid methyl ester, NSC 10128, NSC404188, ZINC00396313, beta-Phenylpropionic acid methyl ester, Hydrocinnamic acid, methyl ester (8CI)

Molecular Formula: C10H12O2Molecular Weight: 164.201080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: RPUSRLKKXPQSGP-UHFFFAOYSA-N


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