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Shanghai Zealing Chemical Co., Ltd.

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Profile: Shanghai Zealing Chemical Co., Ltd. is engaged in advanced chemical intermediates for the pharmaceutical/biotech industry, either by custom synthesis or by contract.

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• 2-Amino-4-Chloro Pyridine
IUPAC Name: 4-chloropyridin-1-ium-2-amine | CAS Registry Number: 19798-80-2
Synonyms: ZINC00966760, CID6973568

Molecular Formula: C5H6ClN2+Molecular Weight: 129.567540 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: RQMWVVBHJMUJNZ-UHFFFAOYSA-O

• 4-NitroBenzonitrile
IUPAC Name: 4-nitrobenzonitrile | CAS Registry Number: 619-72-7
Synonyms: 4-Nitrobenzonitrile, p-Cyanonitrobenzene, Benzonitrile, 4-nitro-, 4-Cyanonitrobenzene, Benzonitrile, p-nitro-, P-NITROBENZONITRILE, CCRIS 2328, N12007_ALDRICH, NSC 5383, EINECS 210-610-0, NSC5383, STK051059, ZINC01680884, AI3-00478, LS-38764, TL8004002, InChI=1/C7H4N2O2/c8-5-6-1-3-7(4-2-6)9(10)11/h1-4

Molecular Formula: C7H4N2O2Molecular Weight: 148.118860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: NKJIFDNZPGLLSH-UHFFFAOYSA-N

• 4-Nitrobiphenyl
IUPAC Name: 1-nitro-4-phenylbenzene | CAS Registry Number: 92-93-3
Synonyms: p-Nitrodiphenyl, 4-Nitrodiphenyl, Biphenyl, 4-nitro-, P-NITROBIPHENYL, p-Phenyl-nitrobenzene, 4-Phenyl-nitrobenzene, p-Phenylnitrobenzene, 1-Nitro-4-phenylbenzene, 4-Phenylnitrobenzene, 1,1'-Biphenyl, 4-nitro-, NITROBIPHENYL, 4-Nitro-1,1'-biphenyl, WLN: WNR DR, CCRIS 443, 1,1'-Biphenyl, nitro-, Ba 2794, HSDB 2632, NSC 1324, EINECS 202-204-7, CID7114

Molecular Formula: C12H9NO2Molecular Weight: 199.205360 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: BAJQRLZAPXASRD-UHFFFAOYSA-N

• 3-Chloro-1-Propanol 4-Methylbenzenesulfonate
IUPAC Name: 3-chloropropyl 4-methylbenzenesulfonate | CAS Registry Number: 632-02-0
Synonyms: NSC859, 3-Chloropropyl p-toluenesulfonate, NSC 859, CID69434, ZINC01587642, Gamma-chloro-n-propyl-p-toluene sulfonate, 1-Propanol, 3-chloro-, 4-methylbenzenesulfonate, 1-Propanol, 3-chloro-, 1-(4-methylbenzenesulfonate)

Molecular Formula: C10H13ClO3SMolecular Weight: 248.726420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: NQCQVNHLNXCSPY-UHFFFAOYSA-N

• 1,2-Benzisoxazole-3-Methanesulfonic Acid Sodium Salt
IUPAC Name: sodium;1,2-benzoxazol-3-ylmethanesulfonate | CAS Registry Number: 73101-64-1
Synonyms: 1,2-BENZISOXAZOLE-3-METHANESULFONIC ACID SODIUM SALT, Sodium Benzo[d]isoxazol-3-ylmethanesulfonate, UNII-61MWM0KQ3O, CTK8B8512, ANW-60534, FD7205, AKOS015895591, AKOS016003171, RP28166, AK-94063, KB-10046, P157, Zonisamide related compound A sodium salt, sodium 1,2-benzoxazol-3-ylmethanesulfonate, 1,2-Benzisoxazole-3-methanesulfonate sodium, FT-0601822, Sodium 1,2-benzisoxazole-3-methanesulfonate, ST51052906, 1,2-benzisoxazole-3-methanesulfonic acid sodium, 1,2-Benzisoxazole-3-methanesulfonate Sodium Salt

Molecular Formula: C8H6NNaO4SMolecular Weight: 235.192309 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: QILCHBOPDIODSB-UHFFFAOYSA-M

• 1,2-Epoxy-9-Decene
IUPAC Name: 2-oct-7-enyloxirane | CAS Registry Number: 85721-25-1
Synonyms: Oct-7-enyloxirane, (7-Octenyl)oxirane, 2-(7-Octenyl)oxirane, 1,2-Epoxy-9-decene, Oxirane, (7-octenyl)-, 410829_ALDRICH, EINECS 288-437-5, CID543758, ZINC02569686

Molecular Formula: C10H18OMolecular Weight: 154.249320 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: FCZHJHKCOZGQJZ-UHFFFAOYSA-N

• 5-(hydroxymethyl)-2-Iodophenol
IUPAC Name: 5-(hydroxymethyl)-2-iodophenol | CAS Registry Number: 773869-57-1
Synonyms: 5-(hydroxymethyl)-2-iodophenol, 3-Hydroxy-4-iodobenzyl alcohol, 3-Hydroxy-4-iodobenzenemethanol, SBB054764, AG-H-09554, zlchem 794, AGN-PC-01XFXE, SureCN513349, AC1Q7C0R, CTK5E4366, ZLD0253, (3-Hydroxy-4-iodophenyl)methanol, MolPort-000-145-319, Benzenemethanol,3-hydroxy-4-iodo-, ACT06127, 5-(hydroxymethyl)-2-iodanyl-phenol, ANW-63391, ZINC12370880, AKOS015889932, AC-4646

Molecular Formula: C7H7IO2Molecular Weight: 250.033750 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: VIWWSAGABDIIFF-UHFFFAOYSA-N

• 3,3-Bis(N,N-Dipropanoic Acid)
IUPAC Name: 3-(2-carboxyethylamino)propanoic acid | CAS Registry Number: 505-47-5
Synonyms: AmbTiB20600, IMINODIPROPIONIC ACID, 3,3'-Iminodipropionic acid, 3,3-Bis(N,N-dipropanoic acid), N-(2-Carboxyethyl)-beta-alanine, MolPort-000-001-416, CID10456, NSC41820, EINECS 208-009-3, B20600, S04-0081

Molecular Formula: C6H11NO4Molecular Weight: 161.155840 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: TXPKUUXHNFRBPS-UHFFFAOYSA-N

• 1-Amino-3,3-diethoxypropane (APEA)
IUPAC Name: 3,3-diethoxypropylazanium | CAS Registry Number: 41365-75-7
Synonyms: ZINC02512238, CID7015552

Molecular Formula: C7H18NO2+Molecular Weight: 148.223320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: PXXMSHBZYAOHBD-UHFFFAOYSA-O

• 2-Bromo-4'-fluoroacetophenone
IUPAC Name: 2-bromo-1-(4-fluorophenyl)ethanone | CAS Registry Number: 403-29-2
Synonyms: p-Fluorophenacyl bromide, Bromo-4-fluoroacetophenone, 4-Fluorophenacyl bromide, 389390_ALDRICH, omega-Bromo-4-fluoroacetophenone, TOS-BB-1137, Acetophenone, 2-bromo-4'-fluoro-, CID96749, NSC88343, EINECS 206-955-1, 2-Bromo-1-(4-fluorophenyl)ethanone, SBB006561, ZINC00152861, 2-Bromo-1-(4-fluorophenyl)ethan-1-one, B157, TL8002931, InChI=1/C8H6BrFO/c9-5-8(11)6-1-3-7(10)4-2-6/h1-4H,5H

Molecular Formula: C8H6BrFOMolecular Weight: 217.035043 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ZJFWCELATJMDNO-UHFFFAOYSA-N

• 3-Chlorostyrene
IUPAC Name: 1-chloro-3-ethenylbenzene | CAS Registry Number: 2039-85-2
Synonyms: Styrene, m-chloro-, M-CHLOROSTYRENE, Styrene, 3-chloro-, Ambap2887, Benzene, 1-chloro-3-ethenyl-, 1-Chloro-3-vinylbenzene, C71009_ALDRICH, Styrene, m-chloro- (8CI), HSDB 3452, NSC18602, EINECS 218-024-7, NSC 18602, Benzene, 1-chloro-3-ethenyl- (9CI)

Molecular Formula: C8H7ClMolecular Weight: 138.594180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: BOVQCIDBZXNFEJ-UHFFFAOYSA-N

• 4-Iodoaniline
IUPAC Name: 4-iodoaniline | CAS Registry Number: 540-37-4
Synonyms: p-Iodoaniline, Aniline, p-iodo-, 4-Iodobenzenamine, 4-IODOANILINE, Benzenamine, 4-iodo-, p-Aminophenyl iodide, Aniline, 4-iodo-, 4-iodo-aniline, WLN: ZR DI, 129364_ALDRICH, CCRIS 9122, NSC 9246, 57700_FLUKA, EINECS 208-743-4, NSC9246, ALD-N033128, ZINC00013615, LS-19847, TL8003546, C013067

Molecular Formula: C6H6INMolecular Weight: 219.023010 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: VLVCDUSVTXIWGW-UHFFFAOYSA-N

• 4-(tert-Butoxycarbonyl)phenylboronic acid
IUPAC Name: [4-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]boronic acid | CAS Registry Number: 850568-54-6
Synonyms: B2009G1

Molecular Formula: C11H15BO4Molecular Weight: 222.045400 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: QMVMDYSTJSUDKC-UHFFFAOYSA-N

• 4-Benzothiazolol
IUPAC Name: 1,3-benzothiazol-4-ol | CAS Registry Number: 7405-23-4
Synonyms: 4-Hydroxybenzothiazole, NSC403244, NSC 403244

Molecular Formula: C7H5NOSMolecular Weight: 151.185700 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: NZFKDDMHHUEVPI-UHFFFAOYSA-N

• 4-Hexanoylresorcinol
IUPAC Name: 1-(2,4-dihydroxyphenyl)hexan-1-one | CAS Registry Number: 3144-54-5
Synonyms: MLS000774909, 2',4'-Dihydroxyhexanophenone, nchembio.2007.32-comp10, NSC163332, CID76596, EINECS 221-555-7, ZINC01635607, 1-(2,4-Dihydroxyphenyl)-1-hexanone, 1-(2,4-Dihydroxyphenyl)hexan-1-one, 1-Hexanone, 1-(2,4-dihydroxyphenyl)-, SMR000365571, TL8002407, AK-087/42718140, T0500-1971

Molecular Formula: C12H16O3Molecular Weight: 208.253640 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: SKUFHZAEFGZSQK-UHFFFAOYSA-N

• [4-(Morpholinomethyl)phenyl]methanol
IUPAC Name: [4-(morpholin-4-ylmethyl)phenyl]methanol | CAS Registry Number: 91271-65-7
Synonyms: [4-(morpholinomethyl)phenyl]methanol, [4-(morpholin-4-ylmethyl)phenyl]methanol, (4-(morpholinomethyl)phenyl)methanol, SDCCGMLS-0066079.P001, zlchem 1288, AC1MDTIF, SureCN171776, ZLE0063, MolPort-000-142-839, SBB093890, ZINC20230745, AKOS000320955, CC29309, RP04622, KB-62828, Y4664, [4-(morpholin-4-ylmethyl)phenyl]methan-1-ol, I14-101664

Molecular Formula: C12H17NO2Molecular Weight: 207.268880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: MWVQMAWLNHACQK-UHFFFAOYSA-N

• 2-Di Methylamino Methyl Cyclohexanone HCL
IUPAC Name: 2-(dimethylaminomethyl)cyclohexan-1-one hydrochloride | CAS Registry Number: 42036-65-7
Synonyms: MLS001029693, NSC620461, 2-Dimethylaminomethyl-cyclohexanone, NSC12467, CID359482, SMR000427042, ST5447148, SR-01000390594-2

Molecular Formula: C9H18ClNOMolecular Weight: 191.698320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CLVHTSWMNNSUSH-UHFFFAOYSA-N

• 4-chloro-1H-indazole
IUPAC Name: 4-chloro-1H-indazole | CAS Registry Number: 13096-96-3
Synonyms: 4-Chloro-1H-indazole, NSC694315, AIDS151960, AIDS-151960, CB-0825, NSC 694315, NCI60_033767

Molecular Formula: C7H5ClN2Molecular Weight: 152.581000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CQTGQYVQJOJQCM-UHFFFAOYSA-N

• 2-methyl-1H-imidazole-4-carbaldehyde
IUPAC Name: 2-methyl-1H-imidazole-5-carbaldehyde | CAS Registry Number: 35034-22-1
Synonyms: 2-Methyl-1H-imidazole-4-carbaldehyde, 2-methyl-1H-imidazole-5-carbaldehyde, 2-Methylimidazole-5-carboxaldehyde, SBB052314, AG-F-20337, 2-METHYL-1H-IMIDAZOLE-4-CARBOXALDEHYDE, AmbkkkkK318, ZINC00164636, zlchem 833, AC1MDUDY, ACMC-209icl, AC1Q2OWJ, 2-methylimidazole-4-carbaldehyde, CTK4H3433, 4-Formyl-2-methyl-1H-imidazole, ZLD0294, MolPort-000-005-056, 2-Methylimidazole-4-Carboxaldehyede, ACT02012, 2-Methyl-imidazole-4-carboxaldehyde

Molecular Formula: C5H6N2OMolecular Weight: 110.113940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: ZWULFIBGPXWGFG-UHFFFAOYSA-N

• 5-Amino-3-ethyl-1,2,4-thiadiazole
IUPAC Name: 3-ethyl-1,2,4-thiadiazol-5-amine | CAS Registry Number: 17467-41-3
Synonyms: 3-ethyl-1,2,4-thiadiazol-5-amine, ZINC02506771, zlchem 1238, AC1MBTJZ, SureCN91381, CTK6D2854, ZLE0013, MolPort-000-151-054, AKOS009578280, AG-A-83312, BP-10176, KB-41582, FT-0692144, A811682, I14-40259

Molecular Formula: C4H7N3SMolecular Weight: 129.183480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: VMSZFGJMDPANBP-UHFFFAOYSA-N

• 1-Naphthoic Acid
IUPAC Name: naphthalene-1-carboxylic acid | CAS Registry Number: 86-55-5
Synonyms: 1-NAPHTHOIC ACID, 1-Carboxynaphthalene, alpha-Naphthoic acid, Carboxynaphthalene, 1-Naphthalenecarboxylic acid, NAPHTHOIC ACID, Naphthalenecarboxylic acid, .alpha.-Naphthoic acid, alpha-Naphthylcarboxylic acid, N1909_ALDRICH, naphthalene-1-carboxylic acid, Naphthalene-alpha-carboxylic acid, 70389_FLUKA, 70390_FLUKA, CHEBI:36466, EINECS 201-681-9, NSC 37569, AIDS034420, AIDS-034420, NSC37569

Molecular Formula: C11H8O2Molecular Weight: 172.180020 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: LNETULKMXZVUST-UHFFFAOYSA-N

• 2,4-Dimethyl Thiazole
IUPAC Name: 2,4-dimethyl-1,3-thiazole | CAS Registry Number: 541-58-2
Synonyms: Thiazole, 2,4-dimethyl-, 2,4-DIMETHYLTHIAZOLE, 2,4-Methylthiazole, 2,4-Dimethyl-1,3-thiazole, D5759_SIGMA, W503401_ALDRICH, NSC7510, NSC 7510, EINECS 208-786-9, WLN: T5N CSJ B1 E1, AIDS230596, AIDS-230596, CID10934, BRN 0106414, ZINC00150863, LS-150974, 4-27-00-00981 (Beilstein Handbook Reference), T5792204

Molecular Formula: C5H7NSMolecular Weight: 113.180780 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: OBSLLHNATPQFMJ-UHFFFAOYSA-N

• 2,6-Dichloro-3-Nitropyridine
IUPAC Name: 2,6-dichloro-3-nitropyridine | CAS Registry Number: 16013-85-7
Synonyms: 2,6-Dichloro-3-nitropyridine, 193585_ALDRICH, BB_SC-2981, Pyridine, 2,6-dichloro-3-nitro-, EINECS 240-151-1, SBB003614, ZINC00967353, D267, TL806195, AC-907/30002032, InChI=1/C5H2Cl2N2O2/c6-4-2-1-3(9(10)11)5(7)8-4/h1-2

Molecular Formula: C5H2Cl2N2O2Molecular Weight: 192.987580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: SHCWQWRTKPNTEM-UHFFFAOYSA-N

• 2,7-Dihydroxy Naphthalene
IUPAC Name: naphthalene-2,7-diol | CAS Registry Number: 582-17-2
Synonyms: 2,7-Naphthalenediol, Naphthalene-2,7-diol, 2,7-DIHYDROXYNAPHTHALENE, CI 76645, Naphthalenediol-2,7 [French], D116408_ALDRICH, NSC 407541, 37781_FLUKA, EINECS 209-478-7, AIDS017777, 2,7-Naphthalenediol (8CI,9CI), C.I. 76645, AIDS-017777, BRN 2042383, NSC407541, ZINC00388554, LS-94572, ST5406389, 4-06-00-06570 (Beilstein Handbook Reference)

Molecular Formula: C10H8O2Molecular Weight: 160.169320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: DFQICHCWIIJABH-UHFFFAOYSA-N

• 3-Hydroxybenzaldehyde
IUPAC Name: 3-hydroxybenzaldehyde | CAS Registry Number: 100-83-4
Synonyms: m-Formylphenol, 3-hydroxybenzaldehyde, 3-Formylphenol, m-Hydroxybenzaldehyde, Benzaldehyde, 3-hydroxy-, meta-Hydroxybenzaldehyde, Benzaldehyde, m-hydroxy-, 3-OH-BENZALDEHYDE, H19808_ALDRICH, 3-HYDROXY-BENZALDEHYDE, NSC 3504, CHEBI:16207, EINECS 202-892-9, NSC3504, BRN 0507099, c0055, ZINC00901630, AI3-12120, LS-25059, ST5213351

Molecular Formula: C7H6O2Molecular Weight: 122.121340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: IAVREABSGIHHMO-UHFFFAOYSA-N

• 3-Indole Acetic Acid
IUPAC Name: 2-(1H-indol-3-yl)acetic acid | CAS Registry Number: 87-51-4
Synonyms: indoleacetic acid, Heteroauxin, Rhizopin, 3-Indoleacetic acid, auxin, indole-3-acetic acid, indoleacetate, Hexteroauxin, Rhizopon A, 1H-Indole-3-acetic acid, indole-3-acetate, Acetic acid, indolyl-, 3-Iaa, beta-Indoleacetic acid, 3-(Carboxymethyl)indole, Heteroauxinhexteroauxiniaa, alpha-IAA, beta-Indolylacetic acid, Indol-3-ylacetic acid, beta-IAA

Molecular Formula: C10H9NO2Molecular Weight: 175.183960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: SEOVTRFCIGRIMH-UHFFFAOYSA-N

• 4,4'-Dichloro Benzophenone
IUPAC Name: bis(4-chlorophenyl)methanone | CAS Registry Number: 90-98-2
Synonyms: 4,4'-Dichlorobenzophenone, DCBP, Di(p-chlorophenyl)ketone, p-Dichlorobenzophenone, USAF DO-4, Bis(4-chlorophenyl) ketone, Bis(p-chlorophenyl)ketone, Di(4-chlorophenyl)ketone, Bis(4-chlorophenyl)ketone, Methanone, bis(4-chlorophenyl)-, DBP (degradation product), DBP (VAN), MET854B_SUPELCO, Bis(4-chlorophenyl)methanone, Benzophenone, 4,4'-dichloro-, WLN: GR DVR DG, P,P'-DICHLOROBENZOPHENONE, 113700_ALDRICH, 45421_RIEDEL, NSC 8787

Molecular Formula: C13H8Cl2OMolecular Weight: 251.108020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: OKISUZLXOYGIFP-UHFFFAOYSA-N

• 4-Bromo-2-Fluoroaniline
IUPAC Name: 4-bromo-2-fluoroaniline | CAS Registry Number: 367-24-8
Synonyms: 4-Bromo-2-fluoroaniline, Benzenamine, 4-bromo-2-fluoro-, nchembio.2007.34-comp12, 304220_ALDRICH, ZINC00152960, EINECS 206-685-4, CID123050, B126, TL806376, ST5213767

Molecular Formula: C6H5BrFNMolecular Weight: 190.013003 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: GZRMNMGWNKSANY-UHFFFAOYSA-N

• 4'-Hydroxy Acetophenone
IUPAC Name: 1-(4-hydroxyphenyl)ethanone | CAS Registry Number: 99-93-4
Synonyms: Piceol, 4'-Hydroxyacetophenone, 4-Acetylphenol, 4-Hydroxyacetophenone, p-Oxyacetophenone, p-Acetylphenol, P-HYDROXYACETOPHENONE, 1-(4-Hydroxyphenyl)ethanone, Phenol, p-acetyl-, para-Hydroxyacetophenone, Acetophenone, 4'-hydroxy-, p-Hydroxacetophenone, Acetophenone, p-hydroxy-, Ethanone, 1-(4-hydroxyphenyl)-, Methyl p-hydroxyphenyl ketone, p-hydroxyaceto-phenone, p-Hydroxyphenyl methyl ketone, 4-hydroxyaceto-phenone, USAF KF-15, (4-Hydroxyphenyl)ethan-1-one

Molecular Formula: C8H8O2Molecular Weight: 136.147920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: TXFPEBPIARQUIG-UHFFFAOYSA-N

• 4-Hydroxy-N-Methyl Piperidine
IUPAC Name: 1-methylpiperidin-4-ol | CAS Registry Number: 106-52-5
Synonyms: N-Methylpiperidol, N-Methyl-4-piperidinol, 1-Methyl-4-piperidinol, 1-Methyl-4-hydroxypiperidine, 4-Hydroxy-N-methylpiperidine, 4-Hydroxy-1-methylpiperidine, 1-Methylpiperidin-4-ol, 4-Piperidinol, 1-methyl-, N-Methyl-4-hydroxypiperidine, H42206_ALDRICH, NSC60705, EINECS 203-406-8, NSC 60705, SBB004301, AI3-27594, TL8000233

Molecular Formula: C6H13NOMolecular Weight: 115.173520 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: BAUWRHPMUVYFOD-UHFFFAOYSA-N

• 2-Bromomethyl Oxirane
IUPAC Name: 2-(bromomethyl)oxirane | CAS Registry Number: 3132-64-7
Synonyms: Epibromohydrin, Epibromhydrin, Epibromohydrine, (Bromomethyl)oxirane, 2-(Bromomethyl)oxirane, Oxirane, (bromomethyl)-, 1-Bromo-2,3-epoxypropane, 2-bromomethyloxiran, (Bromomethyl)ethylene oxide, 3-bromopropylene oxide, 1,2-Epoxy-3-bromopropane, 3-Bromo-1,2-epoxypropane, Epibromhydrine [French], ALPHA-EPIBROMOHYDRIN, Epibromhidrina [Spanish], Propane, 1-bromo-2,3-epoxy-, Propane, 3-bromo-1,2-epoxy-, WLN: T3OTJ B1E, CCRIS 2620, E1012_ALDRICH

Molecular Formula: C3H5BrOMolecular Weight: 136.975200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: GKIPXFAANLTWBM-UHFFFAOYSA-N

• 4-Fluorobiphenyl
IUPAC Name: 1-fluoro-4-phenylbenzene | CAS Registry Number: 324-74-3
Synonyms: p-Fluorodiphenyl, Biphenyl, 4-fluoro-, 4-FLUOROBIPHENYL, para-Fluorobiphenyl, (4-Fluorophenyl)benzene, 4-Fluoro-1,1'-biphenyl, 1,1'-Biphenyl, 4-fluoro-, 553638_ALDRICH, EINECS 206-304-1, CID9461, NSC 56686, NSC56686, 1,1'-Biphenyl, 4-fluoro- (9CI), LS-44388, ST5406393, InChI=1/C12H9F/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9

Molecular Formula: C12H9FMolecular Weight: 172.198263 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: RUYZJEIKQYLEGZ-UHFFFAOYSA-N

• 5-Bromo-2-methylphenylamine
IUPAC Name: 5-bromo-2-methylaniline | CAS Registry Number: 39478-78-9
Synonyms: 5-Bromo-o-toluidine, 5-Bromo-2-methylaniline, 515019_ALDRICH, EINECS 254-467-2, ZINC00403348, TL8002852, InChI=1/C7H8BrN/c1-5-2-3-6(8)4-7(5)9/h2-4H,9H2,1H

Molecular Formula: C7H8BrNMolecular Weight: 186.049120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: RXQNKKRGJJRMKD-UHFFFAOYSA-N

• 4-Isopropylphenylacetic acid
IUPAC Name: 2-(4-propan-2-ylphenyl)acetic acid | CAS Registry Number: 4476-28-2
Synonyms: 7-p-Cymenecarboxylic acid, p-Isopropyl phenyl acetic acid, AIDS017622, AIDS-017622, EINECS 224-755-2, p-ISOPROPYL PHENYLACETIC ACID, Benzeneacetic acid, 4-(1-methylethyl)-, AI3-12008, ST5406790

Molecular Formula: C11H14O2Molecular Weight: 178.227660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: RERBQXVRXYCGLT-UHFFFAOYSA-N

• 4-Bromo-3,3,4,4-tetrafluorobutan-1-ol
IUPAC Name: 4-bromo-3,3,4,4-tetrafluorobutan-1-ol | CAS Registry Number: 234443-21-1
Synonyms: 4-bromo-3,3,4,4-tetrafluorobutan-1-ol, 4-Bromo-3,3,4,4-tetrafluoro-1-butanol, ZINC02555160, zlchem 1314, AC1MC5FO, CTK4F1481, PC1561F, ZLE0090, MolPort-001-772-042, FD2046, SBB096749, AKOS007929963, AG-E-68355, RP27543, AK139971, KB-83990, 1-Butanol,4-bromo-3,3,4,4-tetrafluoro-, 4-Bromo-3,3,4,4-tetrafluorobutan-1-ol;, 4-Bromo-1H,1H,2H,2H-perfluorobutan-1-ol, FT-0676101

Molecular Formula: C4H5BrF4OMolecular Weight: 224.979513 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: RTTCOQHNKANLOS-UHFFFAOYSA-N

• 2 4-Dihydroxy Quinoline
IUPAC Name: 2-hydroxy-1H-quinolin-4-one | CAS Registry Number: 86-95-3
Synonyms: 2,4-Quinolinediol, 2,4-Dihydroxyquinoline, Hydroxycarbostyril, Quinoline-2,4-diol, 4-Hydroxycarbostyril, 4-Hydroxy-2-quinolone, 4-Hydroxy-2-quinolinone, 2,4-Quinolinediol-, CARBOSTYRIL, 4-HYDROXY-, Maybridge1_006493, 2, 4-Dihydroxyquinoline-, 2(1H)-Quinolinone, 4-hydroxy-, 4-Hydroxyquinolin-2(1H)-one, Q1336_ALDRICH, Oprea1_337514, Oprea1_706175, MLS000716246, STOCK1N-24491, EINECS 201-711-0, NSC 12465

Molecular Formula: C9H7NO2Molecular Weight: 161.157380 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: HDHQZCHIXUUSMK-UHFFFAOYSA-N

• 2-Amino Pyrazine
IUPAC Name: pyrazin-2-amine | CAS Registry Number: 5049-61-6
Synonyms: Aminopyrazine, Pyrazinamine, 2-Aminopyrazine, 2-Pyrazinamine, pyrazin-2-amine, pyrazin-2-ylamine, Pyrazine, 2-amino-, AMINO PYRAZINE, A76958_ALDRICH, 09332_FLUKA, 89132_FLUKA, AIDS021254, Pyrazine, 1,2-dihydro-2-imino-, AIDS-021254, NSC13147, EINECS 225-748-7, ENT 60202, SBB004388, ZINC00967322, AI3-60202

Molecular Formula: C4H5N3Molecular Weight: 95.102600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: XFTQRUTUGRCSGO-UHFFFAOYSA-N

• 2-Amino-4,6-Dimethoxypyrimidine
IUPAC Name: 4,6-dimethoxypyrimidin-2-amine | CAS Registry Number: 36315-01-2
Synonyms: Maybridge1_002259, 2-Amino-4,6-dimethoxypyrimidine, Oprea1_751622, 375349_ALDRICH, 4,6-Dimethoxypyrimidin-2-amine, 2-Pyrimidinamine, 4,6-dimethoxy-, EINECS 252-969-6, SBB006932, ZINC00132738, SR-01000634114-1

Molecular Formula: C6H9N3O2Molecular Weight: 155.154560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: LVFRCHIUUKWBLR-UHFFFAOYSA-N

• 3-Methoxy Thiophenol
IUPAC Name: 3-methoxybenzenethiol | CAS Registry Number: 15570-12-4
Synonyms: 3-Methoxythiophenol, 3-Mercaptoanisole, 3-Methoxy thiophenol, 3-Methoxybenzenethiol, m-Methoxythiophenol, meta-Methoxybenzenethiol, Ambap7255, 155705_ALDRICH, EINECS 239-617-7, TL8006751, Y11037

Molecular Formula: C7H8OSMolecular Weight: 140.202820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: QMVAZEHZOPDGHA-UHFFFAOYSA-N

• 4-Pyridine Methanol
IUPAC Name: pyridin-4-ylmethanol | CAS Registry Number: 586-95-8
Synonyms: 4-Pyridylcarbinol, 4-Pyridylmethanol, 4-PYRIDINEMETHANOL, 4-Pyridinecarbinol, 4-Picolyl alcohol, .gamma.-Picolyl alcohol, gamma-Picolyl alcohol, 4-(Hydroxymethyl)pyridine, 4-Pyridyl carbinol, Pyridine-4-methanol, 4-Hydroxymethylpyridine, omega-Hydroxy-4-picoline, PYRIDIN-4-YLMETHANOL, 151629_ALDRICH, 55790_FLUKA, EINECS 209-590-6, NSC 26024, NSC 49167, CID11472, NSC26024

Molecular Formula: C6H7NOMolecular Weight: 109.125880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: PTMBWNZJOQBTBK-UHFFFAOYSA-N

• 2-(Chloro-Trifluoromethy)Pyridine
IUPAC Name: 2-chloro-3-(trifluoromethyl)pyridine | CAS Registry Number: 65753-47-1
Synonyms: TPC-PY034, 2-Chloro-3-(trifluoromethyl)pyridine, 2-Chloro-3-trifluoromethylpyridine, 469378_ALDRICH, ZINC02584285, CID589833, C240, TL8004664, 3S210998

Molecular Formula: C6H3ClF3NMolecular Weight: 181.542930 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: RXATZPCCMYMPME-UHFFFAOYSA-N

• 4-Phenylpyridine
IUPAC Name: 4-phenylpyridine | CAS Registry Number: 939-23-1
Synonyms: 4-PHENYLPYRIDINE, p-Phenylpyridine, Pyridine, 4-phenyl-, AZABIPHENYL, P33429_ALDRICH, 79090_FLUKA, EINECS 213-357-4, NSC 70375, NSC 77935, NSC70375, NSC77935, BRN 0110490, SBB008518, ZINC00967333, FR-2206, LS-131888, 5-20-07-00549 (Beilstein Handbook Reference), AC-907/25014285, InChI=1/C11H9N/c1-2-4-10(5-3-1)11-6-8-12-9-7-11/h1-9, 52642-16-7

Molecular Formula: C11H9NMolecular Weight: 155.195860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: JVZRCNQLWOELDU-UHFFFAOYSA-N

• 6-Bromooxindole
IUPAC Name: 6-bromo-1,3-dihydroindol-2-one | CAS Registry Number: 99365-40-9
Synonyms: 6-Bromo-2-oxindole, 586595_ALDRICH, ZINC02577874, CID2773289, SL-02639, TL8006064

Molecular Formula: C8H6BrNOMolecular Weight: 212.043340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: JARRYVQFBQVOBE-UHFFFAOYSA-N

• 3,3-Diethoxypropionic acid ethylester (DEPE)
IUPAC Name: ethyl 3,3-diethoxypropanoate | CAS Registry Number: 10601-80-6
Synonyms: Ethyl 3,3-diethoxypropionate, NCIOpen2_001167, Ethyl 3,3-diethoxypropanoate, 414476_ALDRICH, NSC83149, EINECS 234-223-1, ZINC01730613, Propanoic acid, 3,3-diethoxy-, ethyl ester, AI3-22276, Malonaldehydic acid ethyl ester diethylacetal

Molecular Formula: C9H18O4Molecular Weight: 190.236820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: SIALOQYKFQEKOG-UHFFFAOYSA-N

• 5-Fluorocytosine
IUPAC Name: 6-amino-5-fluoro-1H-pyrimidin-2-one | CAS Registry Number: 2022-85-7
Synonyms: flucytosine, Fluocytosine, Flucytosin, Ancobon, Fluorcytosine, Ancotil, 5-Fluorocytosin, 5-Fluorocystosine, Alcobon, Fluorocytosine, Flucytosone, Ancotyl, Cytosine, 5-fluoro-, 5-Flurocytosine, 5-FC, Ancobon (TN), Flucitosina [DCIT], Flucytosinum [INN-Latin], 5-Fluorocytosine-6-3H, Prestwick0_000934

Molecular Formula: C4H4FN3OMolecular Weight: 129.092463 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: XRECTZIEBJDKEO-UHFFFAOYSA-N

• 5-Amino-tetrazole mono-hydrate
IUPAC Name: 2H-tetrazol-5-amine | CAS Registry Number: 4418-61-5
Synonyms: 5-Aminotetrazole, Aminotetrazole, 1H-Tetrazol-5-amine, Tetrazol-5-ylamine, 1H-Tetrazole, 5-amino-, 5-AMINO-1H-TETRAZOLE, 5-Amino-1,2,3,4-tetrazole, 550728_ALDRICH, NSC 3004, EINECS 224-581-7, NSC3004, AIDS020354, AIDS-020354, SBB004398, AI3-23021, LS-149081, TL8003081, EU-0000391, 167101-82-8, 29212-86-0

Molecular Formula: CH3N5Molecular Weight: 85.068020 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: ULRPISSMEBPJLN-UHFFFAOYSA-N

• 2-(2-chloroethyl)benzimidazole
IUPAC Name: 2-(2-chloroethyl)-1H-benzimidazole | CAS Registry Number: 405173-97-9
Synonyms: 2-(2-Cloroethyl)benzimidazole, zlchem 856, SureCN4065464, CTK4I3260, ZLD0317, MolPort-003-986-830, ACT05697, SBB070735, ZINC21299241, 1H-Benzimidazole,2-(2-chloroethyl)-, 2-(2-Chloroethyl)-1H-benzimidazole;, AKOS009144450, AG-F-43733, 2-(2-Chloroethyl)-1H-benzo[d]imidazole, AK-45392, U928, KB-162359, TL8002950, FT-0658119, S14-0585

Molecular Formula: C9H9ClN2Molecular Weight: 180.634160 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: TUGGOLWUZCCVBF-UHFFFAOYSA-N

• 4-Chloropyrazole
IUPAC Name: 4-chloro-1H-pyrazole | CAS Registry Number: 15878-00-9
Synonyms: 4-Chloro-1H-pyrazole, 1H-Pyrazole, 4-chloro-, PYRAZOLE, 4-CHLORO-, 1H-Pyrazole, 4-chloro- (9CI), ALBB-000288, BRN 0106355, SBB000035, ZINC01049758, LS-128389, TL8001202, L-21842, 5-23-04-00164 (Beilstein Handbook Reference)

Molecular Formula: C3H3ClN2Molecular Weight: 102.522320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: BADSZRMNXWLUKO-UHFFFAOYSA-N

• 4-(tert-Butoxycarbonyl)morpholine-2-Carboxylic Acid
IUPAC Name: (2R)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-2-carboxylate | CAS Registry Number: 189321-66-2
Synonyms: ZINC04203806

Molecular Formula: C10H16NO5-Molecular Weight: 230.237740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: LGWMTRPJZFEWCX-SSDOTTSWSA-M

• 5-Amino-1,4-Benzodioxane
IUPAC Name: 2,3-dihydro-1,4-benzodioxin-5-amine | CAS Registry Number: 16081-45-1
Synonyms: 5-Amino-1,4-benzodioxane, 2,3-dihydro-1,4-benzodioxin-5-amine, 2,3-Dihydrobenzo[b][1,4]dioxin-5-amine, 2,3-Dihydro-benzo[1,4]dioxin-5-ylamine, 2,3-ETHYLENEDIOXYANILINE, 5-AMINO-1,4-BENZODIOXAN, 5-AMINO-1,4-DIBENZODIOXANE, SBB052002, AG-E-10400, 5-AMINO-2,3-DIHYDRO-1,4-BENZODIOXIN, 5-AMINO-2,3-DIHYDRO-1,4-BENZODIOXINE, 2,3-DIHYDRO-BENZO[B][1,4]DIOXINE-5-AMINE, 5-Amino-2,3-dihydro-1,4-benzodioxine hydrochloride, zlchem 641, ACMC-1BOV8, SureCN253657, AC1Q51CO, KSC530K9R, AGN-PC-00G6E8, CTK4D0598

Molecular Formula: C8H9NO2Molecular Weight: 151.162560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DMLRSJNZORFCBD-UHFFFAOYSA-N


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