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Profile: GTH Chimie Fine - Fine Chemicals deals with fine chemicals, chemical intermediates, active pharmaceutical ingredients and nutraceuticals. Our products include (1-benzyl-4-piperidyl)methanol, (1-ethoxyethylidene)malononitrile, (1-propynyl)tributylstannane, (1s,4s)-2-boc-2,5-diazabicyclo(2.2.1)heptane, 3,6-bis(tert.-butyl)carbazole and '1-(tert.-butoxycarbonyl)-3-piperidone.

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• 1-Carbethoxymethyl-Triphenylphosphonium Chloride
IUPAC Name: (2-ethoxy-2-oxoethyl)-triphenylphosphanium chloride | CAS Registry Number: 17577-28-5
Synonyms: CID87159, EINECS 241-548-2, (Carbethoxymethyl)triphenylphosphonium chloride, ST5405859, (2-Ethoxy-2-oxoethyl)triphenylphosphonium chloride, Phosphonium, (2-ethoxy-2-oxoethyl)triphenyl-, chloride

Molecular Formula: C22H22ClO2PMolecular Weight: 384.835641 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: DJGHVEPNEJKZBF-UHFFFAOYSA-M

• 4,6-Dihydroxy-5-methylpyrimidine
IUPAC Name: 4-hydroxy-5-methyl-1H-pyrimidin-6-one | CAS Registry Number: 63447-38-1
Synonyms: 5-methylpyrimidine-4,6-diol, 5-Methyl-4,6-pyrimidinediol, 18337-63-8, AC-907/30003039, AC1LBDWR, AC1Q6BPN, SureCN2232292, SureCN6765002, KSC490S5J, 5-Methyl-4,6-pyrimidinediol;, 5-Methyl-pyrimidine-4,6-diol, 591025_ALDRICH, CTK3J0954, CTK8H3537, MolPort-001-770-639, Pyrimidine-4,6-diol, 5-methyl-, ACT09965, ANW-59985, AR-1G9054, SBB085633

Molecular Formula: C5H6N2O2Molecular Weight: 126.113340 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: OREVOAMPEBWISR-UHFFFAOYSA-N

• 3-Cyclohexene-1,1-Dimethanol
IUPAC Name: [1-(hydroxymethyl)cyclohex-3-en-1-yl]methanol | CAS Registry Number: 2160-94-3
Synonyms: 3-CYCLOHEXENE-1,1-DIMETHANOL, 4,4-Bis(hydroxymethyl)cyclohexene, Cyclohex-2-ene-1,1-dimethanol, 1,1-Bis(hydroxymethyl)-3-cyclohexene, 4,4-Bis(hydroxymethyl)-1-cyclohexene, 162159_ALDRICH, EINECS 218-481-2, 3-Cyclohexene-1-ylidenedimethanol, NSC112688, BB_NC-0140, NSC 112688, CID16544, BRN 2040659, ZINC03861241, LS-57506, 3-06-00-04131 (Beilstein Handbook Reference)

Molecular Formula: C8H14O2Molecular Weight: 142.195560 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: YXEBFFWTZWGHEY-UHFFFAOYSA-N

• 2-Amino-4'-methylbenzophenone
IUPAC Name: (2-aminophenyl)-(4-methylphenyl)methanone | CAS Registry Number: 36192-63-9
Synonyms: 2-Amino-4'-methylbenzophenone m, EINECS 252-905-7, SBB005854, ZINC00394655, Methanone, (2-aminophenyl)(4-methylphenyl)-

Molecular Formula: C14H13NOMolecular Weight: 211.259120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: RMMJUQSANCPTMV-UHFFFAOYSA-N

• 5-Bromo-2-fluorophenylboronic acid
IUPAC Name: (5-bromo-2-fluorophenyl)boronic acid | CAS Registry Number: 112204-57-6
Synonyms: 5-Bromo-2-fluorobenzeneboronic acid, SBB071276, (5-bromo-2-fluorophenyl)boronic acid, ACMC-2099dc, SureCN1529185, KSC493S1N, 593621_ALDRICH, CTK3J3916, MolPort-001-775-313, ANW-16414, AKOS015834774, AB22346, AG-D-31173, RL00492, RP27145, AK-40224, AK-54281, BP-11419, KB-42056, (5-bromanyl-2-fluoranyl-phenyl)boronic acid

Molecular Formula: C6H5BBrFO2Molecular Weight: 218.816103 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: IGBDPRKNAFOOGY-UHFFFAOYSA-N

• 2,3-Dimethylmaleic anhydride
IUPAC Name: 3,4-dimethylfuran-2,5-dione | CAS Registry Number: 766-39-2
Synonyms: Dimethylmaleic anhydride, Pyrocinchonic anhydride, Maleic anhydride, dimethyl-, 2,5-Furandione, 3,4-dimethyl-, Dimethylmaleic acid anhydride, 2,3-DIMETHYLMALEIC ANHYDRIDE, HSDB 5517, D167800_ALDRICH, WLN: T5VOVJ D1 E1, 3,4-dimethylfuran-2,5-dione, alpha,beta-Dimethylmaleic anhydride, 40750_FLUKA, EINECS 212-165-8, NSC 92512, NSC92512, .alpha.,.beta.-Dimethylmaleic anhydride, LS-88665, InChI=1/C6H6O3/c1-3-4(2)6(8)9-5(3)7/h1-2H

Molecular Formula: C6H6O3Molecular Weight: 126.110040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: MFGALGYVFGDXIX-UHFFFAOYSA-N

• 4-Bromo-2-Fluorophenyl Isocyanate
IUPAC Name: 4-bromo-2-fluoro-1-isocyanatobenzene | CAS Registry Number: 88112-75-8
Synonyms: 472158_ALDRICH, ZINC02568114, 4-Bromo-2-fluorophenyl isocyanate, BBV-086198, CID2733365

Molecular Formula: C7H3BrFNOMolecular Weight: 216.007223 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: LXTYHGYKFYTBGJ-UHFFFAOYSA-N

• 4-Biphenylacetonitrile
IUPAC Name: 2-(4-phenylphenyl)acetonitrile | CAS Registry Number: 31603-77-7
Synonyms: p-Biphenylacetonitrile, p-Biphenylylacetonitrile, p-Phenyl benzyl cyanide, 4-Biphenylylacetonitrile, 4-Phenylphenylacetonitrile, 4-CYANOMETHYLBIPHENYL, [1,1'-Biphenyl]-4-acetonitrile, 133612_ALDRICH, 2-(4-phenyl-phenyl)-acetonitrile, NSC114981, SBB005894, ZINC01704884

Molecular Formula: C14H11NMolecular Weight: 193.243840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: HSZCNGTZJWZAMF-UHFFFAOYSA-N

• 1-Chloro-3-Iodopropane
IUPAC Name: 1-chloro-3-iodopropane | CAS Registry Number: 6940-76-7
Synonyms: 1-Chloro-3-iodopropane, Iodopropanes, 3-Chloropropyl iodide, Propane, 1-chloro-3-iodo-, Trimethylene chloroiodide, 234478_ALDRICH, NSC60189, CID81363, EINECS 230-088-8, NSC 60189, InChI=1/C3H6ClI/c4-2-1-3-5/h1-3H

Molecular Formula: C3H6ClIMolecular Weight: 204.437210 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: SFOYQZYQTQDRIY-UHFFFAOYSA-N

• 4-Bromo-2,6-di-tert-butylphenol
IUPAC Name: 4-bromo-2,6-ditert-butylphenol | CAS Registry Number: 1139-52-2
Synonyms: 394378_ALDRICH, NSC98406, EINECS 214-521-8, ZINC00136156, Phenol, 4-bromo-2,6-di-tert-butyl-, Phenol, 4-bromo-2,6-bis(1,1-dimethylethyl)-, ST029275, 5-BROMO,1,3-DITERT.BUTYL,2-HYDROXY-BENZENE, InChI=1/C14H21BrO/c1-13(2,3)10-7-9(15)8-11(12(10)16)14(4,5)6/h7-8,16H,1-6H

Molecular Formula: C14H21BrOMolecular Weight: 285.219940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: SSQQUEKFNSJLKX-UHFFFAOYSA-N

• (2-Chloro-Phenyl)-Methanesulfonyl Chloride
IUPAC Name: (2-chlorophenyl)methanesulfonyl chloride | CAS Registry Number: 77421-13-7
Synonyms: 2-Chlorobenzylsulfonyl chloride, (2-Chlorophenyl)methanesulfonyl chloride, 678643_ALDRICH, ALBB-001017, STK502407, 2-Chlorobenzenemethanesulfonyl chloride, 2-Chloro-alpha-toluenesulfonyl chloride, BBV-010376, CID2757801

Molecular Formula: C7H6Cl2O2SMolecular Weight: 225.092340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: CHPZYFXSICSCNY-UHFFFAOYSA-N

• 3,5-Dibromobenzeneboronic acid
IUPAC Name: (3,5-dibromophenyl)boronic acid | CAS Registry Number: 117695-55-3
Synonyms: 3,5-Dibromophenylboronic acid, 499501_ALDRICH, D285, ST5408642, TL8000492, InChI=1/C6H5BBr2O2/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3,10-11

Molecular Formula: C6H5BBr2O2Molecular Weight: 279.721700 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: WQBLCGDZYFKINX-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

• (S)-2-Methoxymethylpyrrolidine
IUPAC Name: 2-(methoxymethyl)pyrrolidine | CAS Registry Number: 63126-47-6
Synonyms: 2-(Methoxymethyl)pyrrolidine, (S)-(+)-2-(Methoxymethyl)pyrrolidine, Pyrrolidine, 2-(methoxymethyl)-, NSC305701, CID143953

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

InChIKey: CHPRFKYDQRKRRK-UHFFFAOYSA-N

• 4-Amino-N-(2-hydroxyethyl)benzenesulfonamide
IUPAC Name: 4-amino-N-(2-hydroxyethyl)benzenesulfonamide | CAS Registry Number: 4862-94-6
Synonyms: 4-amino-N-(2-hydroxyethyl)benzenesulfonamide, AC1L9URO, SureCN2563975, Oprea1_203734, CBDivE_007621, AC1Q51Y4, STOCK1S-21418, CTK4J0913, MolPort-000-145-227, HMS1578E13, N(1)-(2-Hydroxyethyl)sulfanilamide, STL299937, ZINC02165128, AKOS009096602, 4-[(2-Hydroxyethyl)sulphamoyl]aniline, AG-F-64485, MCULE-7988516732, KB-189319, FT-0635464, S-(4-aminophenyl)-2-hydroxyethanesulfonamido

Molecular Formula: C8H12N2O3SMolecular Weight: 216.257480 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: NLESYSQTERIDQP-UHFFFAOYSA-N

• 3-Bromo-4-methoxybenzaldehyde
IUPAC Name: 3-bromo-4-methoxybenzaldehyde | CAS Registry Number: 34841-06-0
Synonyms: 3-Bromo-p-anisaldehyde, 412015_ALDRICH, Benzaldehyde, 3-bromo-4-methoxy-, NSC158162, CID98662, EINECS 252-241-8, ZINC00080723, TL8002588, A0927/0043386

Molecular Formula: C8H7BrO2Molecular Weight: 215.043980 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: QMPNFQLVIGPNEI-UHFFFAOYSA-N

• 2-Chloro-5-Nitro Benzaldehyde
IUPAC Name: 2-chloro-5-nitrobenzaldehyde | CAS Registry Number: 6361-21-3
Synonyms: 2-Chloro-5-nitrobenzaldehyde, 3-Nitro-6-chlorobenzaldehyde, WLN: WNR DG CVH, Benzaldehyde, 2-chloro-5-nitro-, 139033_ALDRICH, EINECS 228-830-0, AIDS020861, NSC 129753, AIDS-020861, BRN 0743764, NSC129753, ZINC01870621, LS-24971, ST5213450, 4-07-00-00609 (Beilstein Handbook Reference), InChI=1/C7H4ClNO3/c8-7-2-1-6(9(11)12)3-5(7)4-10/h1-4

Molecular Formula: C7H4ClNO3Molecular Weight: 185.564560 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: VFVHWCKUHAEDMY-UHFFFAOYSA-N

• 4-Bromo-2-ethylaniline
IUPAC Name: 4-bromo-2-ethylaniline | CAS Registry Number: 45762-41-2
Synonyms: ST50408772, ZINC00157192, ACMC-20amnq, AC1MCUYS, PubChem23174, SureCN382588, 4-bromo-2-ethylphenylamine, AC1Q2TA7, 4-bromanyl-2-ethyl-aniline, 515434_ALDRICH, Benzenamine, 4-bromo-2-ethyl-, CTK1D2111, MolPort-001-791-720, CK1159, GEO-00440, AKOS002673925, MCULE-5082179424, AK-98699, KB-189689, FT-0617763

Molecular Formula: C8H10BrNMolecular Weight: 200.075700 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: LGOZNQPHTIGMQJ-UHFFFAOYSA-N

• 4-(2-Bromoethyl)Benzoic Acid
IUPAC Name: 4-(2-bromoethyl)benzoic acid | CAS Registry Number: 52062-92-7
Synonyms: 4-(2-Bromoethyl)benzoic acid, 4'-(2-Bromoethyl)benzoic acid, p-(.beta.-Bromoethyl)benzoic acid, EINECS 257-632-7, p(beta-BROMOETHYL)BENZOIC ACID, CID104068

Molecular Formula: C9H9BrO2Molecular Weight: 229.070560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: BKMRWJWLBHHGCF-UHFFFAOYSA-N

• 4-Bromo-2-methylphenyl isocyanate
IUPAC Name: 4-bromo-1-isocyanato-2-methylbenzene | CAS Registry Number: 1591-98-6
Synonyms: 4-bromo-1-isocyanato-2-methylbenzene, ST50827063, 4-bromo-2-methylbenzenisocyanate, ZINC00164904, ACMC-1BPQH, AC1Q2EKK, AC1MC3O4, 5-Bromo-2-isocyanatotoluene, 478172_ALDRICH, CTK4C9994, MolPort-000-146-195, GEO-00502, SBB094574, AKOS005258249, AG-E-08530, MCULE-2037909494, Benzene,4-bromo-1-isocyanato-2-methyl-, 4-bromanyl-1-isocyanato-2-methyl-benzene, BP-12360, KB-72158

Molecular Formula: C8H6BrNOMolecular Weight: 212.043340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: NXAYRHQYINQHRF-UHFFFAOYSA-N

• 1-Bromo-N,N,2-trimethylpropenylamine
IUPAC Name: 1-bromo-N,N,2-trimethylprop-2-en-1-amine | CAS Registry Number: 73630-93-0
Synonyms: AG-G-91487, CTK5D8389, 1-BROMO-N,N,2-TRIMETHYLALLYLAMINE, 1-Bromo-N,N,2-trimethylpropenylamine,98%;, 1-Propen-1-amine,1-bromo-N,N,2-trimethyl-

Molecular Formula: C6H12BrNMolecular Weight: 178.070180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: LUEGTOVASPUABD-UHFFFAOYSA-N

• 4-Amino-1,2,2,6,6-pentamethylpiperidine
IUPAC Name: (1,2,2,6,6-pentamethylpiperidin-1-ium-4-yl)azanium | CAS Registry Number: 40327-96-6
Synonyms: ZINC00066134, CID6922277

Molecular Formula: C10H24N2+2Molecular Weight: 172.310960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 0

InChIKey: CGXOAAMIQPDTPE-UHFFFAOYSA-P

• 4-Cholesten-3-One
IUPAC Name: (8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one | CAS Registry Number: 601-57-0
Synonyms: Cholestenone, Cholesterone, cholest-4-en-3-one, 4-Cholesten-3-one, 3-Oxocholest-4-ene, 3-Oxo-4-cholestene, 3-Keto-4-cholestene, delta(sup 4)-Cholestenone, bmse000519, (+)-4-Cholesten-3-one, 188174_ALDRICH, 26720_FLUKA, CHEBI:16175, EINECS 210-005-1, CPD-323, NSC 63000, BB_NC-0624, NSC 134926, CID91477, LMST01010015

Molecular Formula: C27H44OMolecular Weight: 384.637660 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: NYOXRYYXRWJDKP-GYKMGIIDSA-N

• 3-Chloro-4-methoxybenzoic acid
IUPAC Name: 3-chloro-4-methoxybenzoic acid | CAS Registry Number: 37908-96-6
Synonyms: 3-Chloro-p-anisic acid, 653179_ALDRICH, Benzoic acid, 3-chloro-4-methoxy-, EINECS 253-708-9, ST5121169

Molecular Formula: C8H7ClO3Molecular Weight: 186.592380 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: IBCQUQXCTOPJOD-UHFFFAOYSA-N

• 2,3-Dichloro Benzoic Acid
IUPAC Name: 2,3-dichlorobenzoic acid | CAS Registry Number: 50-45-3
Synonyms: 2,3-DICHLOROBENZOIC ACID, Benzoic acid, 2,3-dichloro-, 225339_ALDRICH, 34329_RIEDEL, EINECS 200-039-5, BRN 1946217, SBB003641, AI3-33364, FR-2156, LS-1305, NCGC00091187-01, TL8003347, 4-09-00-00998 (Beilstein Handbook Reference), InChI=1/C7H4Cl2O2/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3H,(H,10,11

Molecular Formula: C7H4Cl2O2Molecular Weight: 191.011460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: QAOJBHRZQQDFHA-UHFFFAOYSA-N

• 4-Bromo Ethyl Benzene
IUPAC Name: 1-bromo-4-ethylbenzene | CAS Registry Number: 1585-07-5
Synonyms: p-Bromoethylbenzene, p-Ethylbromobenzene, 4-Ethylbromobenzene, Benzene, 1-bromo-4-ethyl-, 1-BROMO-4-ETHYLBENZENE, 111414_ALDRICH, NSC60144, CID15313, EINECS 216-439-8, NSC 60144, ST5406251, InChI=1/C8H9Br/c1-2-7-3-5-8(9)6-4-7/h3-6H,2H2,1H

Molecular Formula: C8H9BrMolecular Weight: 185.061060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: URFPRAHGGBYNPW-UHFFFAOYSA-N

• 1,3-Dibromoacetone
IUPAC Name: 1,3-dibromopropan-2-one | CAS Registry Number: 816-39-7
Synonyms: sGQDLLRxbRwSP@, Lithium diethylamide, 1,3-Dibromo-2-propanone, 2-Propanone, 1,3-dibromo-, 1,3-dibromopropan-2-one, 13-DIBROMOPROPAN-2-ONE, CID69952, EINECS 212-430-8, NSC249810, 1,3-DIBROMO ACETONE (SYM.), NSC 249810

Molecular Formula: C3H4Br2OMolecular Weight: 215.871260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: LQQKDSXCDXHLLF-UHFFFAOYSA-N

• 2,5-Dichloro-3-methylthiophene
IUPAC Name: 2,5-dichloro-3-methylthiophene | CAS Registry Number: 17249-90-0
Synonyms: 668362_ALDRICH, 2,5-Dichloro-3-methyl-thiophene, NSC109398, CID268910, ST5410601, TL8001361

Molecular Formula: C5H4Cl2SMolecular Weight: 167.056260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: BUWSFDLUTRHPBO-UHFFFAOYSA-N

• 5-Bromo-1-pentene
IUPAC Name: 5-bromopent-1-ene | CAS Registry Number: 1119-51-3
Synonyms: 1-Bromo-4-pentene, 1-Pentene, 5-bromo-, 5-Bromopent-1-ene, 253901_ALDRICH, EINECS 214-281-4, InChI=1/C5H9Br/c1-2-3-4-5-6/h2H,1,3-5H

Molecular Formula: C5H9BrMolecular Weight: 149.028960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: LPNANKDXVBMDKE-UHFFFAOYSA-N

• 2-Bromonaphthalene
IUPAC Name: 2-bromonaphthalene | CAS Registry Number: 580-13-2
Synonyms: Naphthalene, 2-bromo-, 2-BROMONAPHTHALENE, 2-Naphthyl bromide, beta-Bromonaphthalene, .beta.-Bromonaphthalene, beta-Naphthyl bromide, .beta.-Naphthyl bromide, 183644_ALDRICH, 17660_FLUKA, NSC4011, NSC 4011, EINECS 209-452-5, AI3-19928, ST5406686, TL8003726, InChI=1/C10H7Br/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7

Molecular Formula: C10H7BrMolecular Weight: 207.066580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: APSMUYYLXZULMS-UHFFFAOYSA-N

• 1-Bromo-3,4-dimethoxybenzene
IUPAC Name: 4-bromo-1,2-dimethoxybenzene | CAS Registry Number: 2859-78-1
Synonyms: 4-Bromoveratrole, p-Bromoveratrole, 3,4-Dimethoxybromobenzene, 4-Bromo-1,2-dimethoxybenzene, 3,4-Dimethoxyphenyl bromide, Benzene, 4-bromo-1,2-dimethoxy-, B83355_ALDRICH, NSC36284, EINECS 220-677-8, NSC 36284, ZINC00057133, AI3-21224, ST5308173, TL8006990

Molecular Formula: C8H9BrO2Molecular Weight: 217.059860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: KBTMGSMZIKLAHN-UHFFFAOYSA-N

• 3-Chloro-4-nitrotoluene
IUPAC Name: 2-chloro-4-methyl-1-nitrobenzene | CAS Registry Number: 38939-88-7
Synonyms: 643963_ALDRICH, ZINC02583415, Benzene, 2-chloro-4-methyl-1-nitro-, EINECS 254-199-6, CID123478

Molecular Formula: C7H6ClNO2Molecular Weight: 171.581040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: KGSQRFPDZCBVBS-UHFFFAOYSA-N

• 3,5-Dichloro Benzaldehyde
IUPAC Name: 3,5-dichlorobenzaldehyde | CAS Registry Number: 10203-08-4
Synonyms: 3,5-Dichlorobenzaldehyde, Benzaldehyde, 3,5-dichloro-, 3,5-Dichloro-benzaldehyde, 139408_ALDRICH, TPC-B008, NSC109095, CID35746, EINECS 233-499-0, ZINC00165019, NSC 109095, ST5308523, InChI=1/C7H4Cl2O/c8-6-1-5(4-10)2-7(9)3-6/h1-4

Molecular Formula: C7H4Cl2OMolecular Weight: 175.012060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: CASRSOJWLARCRX-UHFFFAOYSA-N

• 2-Acetyl-3,6-Difluorobenzoic Acid
IUPAC Name: 2-acetyl-3,6-difluorobenzoic acid | CAS Registry Number: 319457-34-6
Synonyms: 2-acetyl-3,6-difluorobenzoic acid, AC1MCGYD, ACMC-1AHBE, acetyldifluorobenzoic acid, SureCN3757971, CTK4G7953, MolPort-000-150-828, PC3688, SBB092565, AKOS005257930, Benzoic acid,2-acetyl-3,6-difluoro-, AG-F-06620, AK-25763, KB-19357, 2-ethanoyl-3,6-bis(fluoranyl)benzoic acid, FT-0600100, A821066, I14-94251, 2-Acetyl-3,6-difluorobenzoicacid;2-acetyl-3,6-difluorobenzoic acid;Benzoic acid, 2-acetyl-3,6-difluoro-;

Molecular Formula: C9H6F2O3Molecular Weight: 200.138946 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: IHGWIRJWNPNDTJ-UHFFFAOYSA-N

• 3,5-Diacetoxybenzoic Acid
IUPAC Name: 3,5-diacetyloxybenzoic acid | CAS Registry Number: 35354-29-1
Synonyms: 3,5-Diacetoxybenzoic acid, 3,5-diacetyloxybenzoic acid, 3,5-Bis(acetyloxy)benzoic acid, ST50825867, Maybridge1_004330, AC1LBPBM, ACMC-209igc, SureCN417129, Oprea1_191803, Jsp006374, CTK4H4354, HMS553M20, QBTDQJMLMVEUTQ-UHFFFAOYSA-, MolPort-001-760-015, Benzoic acid,3,5-bis(acetyloxy)-, ANW-28186, BBL002128, Benzoic acid, 3,5-bis(acetyloxy)-, STK894907, AKOS005614430

Molecular Formula: C11H10O6Molecular Weight: 238.193500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: QBTDQJMLMVEUTQ-UHFFFAOYSA-N

• 4-Bromophenylacetic acid
IUPAC Name: 2-(4-bromophenyl)acetic acid | CAS Registry Number: 1878-68-8
Synonyms: 4-Bromophenyl acetate, (4-Bromophenyl)acetic acid, 4-Bromobenzeneacetic acid, 4-Bromophenyl acetic acid, P-BROMOPHENYLACETIC ACID, (p-Bromophenyl)acetic acid, Benzeneacetic acid, 4-bromo-, 2-(4-Bromophenyl)acetic acid, Acetic acid, (p-bromophenyl)-, p-Bromphenylessigsaure [German], 138673_ALDRICH, EINECS 217-523-7, Acide p-bromophenylacetique [French], NSC 14358, NSC14358, BRN 0972146, LS-11168, ST5308544, TL8001523, C03076

Molecular Formula: C8H7BrO2Molecular Weight: 215.043980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: QOWSWEBLNVACCL-UHFFFAOYSA-N

• 2-Amino-4-chlorobenzothiazole
IUPAC Name: 4-chloro-1,3-benzothiazol-2-amine | CAS Registry Number: 19952-47-7
Synonyms: 2-Benzothiazolamine, 4-chloro-, 2-AMINO-4-CHLOROBENZOTHIAZOLE, 4-Chlorobenzothiazol-2-ylamine, Benzothiazole, 2-amino-4-chloro-, MLS000678672, MLS002152865, 133434_ALDRICH, EINECS 243-439-5, CID29872, NSC44404, BRN 0136784, 4-Chloro-1,3-benzothiazol-2-amine, LS-980, SBB000250, ZINC00119425, NCGC00091638-01, SMR000323910, 4-27-00-04859 (Beilstein Handbook Reference), InChI=1/C7H5ClN2S/c8-4-2-1-3-5-6(4)10-7(9)11-5/h1-3H,(H2,9,10

Molecular Formula: C7H5ClN2SMolecular Weight: 184.646000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: OEQQFQXMCPMEIH-UHFFFAOYSA-N

• 4-Cyanobenzoyl Chloride
IUPAC Name: 4-cyanobenzoyl chloride | CAS Registry Number: 6068-72-0
Synonyms: 4-Cyanobenzoyl chloride, Ambap5757, p-CYANOBENZOYL CHLORIDE, 124826_ALDRICH, ZINC02140882, CID80172, EINECS 228-005-5

Molecular Formula: C8H4ClNOMolecular Weight: 165.576460 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: USEDMAWWQDFMFY-UHFFFAOYSA-N

• 4-Tert-Butylcalix[6]Arene
Synonyms: 4-tert-Butylcalix[6]arene, 363693_ALDRICH, 19723_FLUKA, CHEBI:51251, NSC344029, JFD00655, CID335356, 5,11,17,23,29,35-hexa-tert-butylheptacyclo[31.3.1.1(3,7).1(9,13).1(15,19).1(21,25).1(27,31)]dotetraconta-1(37),3(42),4,6,9(41),10,12,15(40),16,18,21(39),22,24,27(38),28,30,33,35-octadecaene-37,38,39,40,41,42-hexol

Molecular Formula: C66H84O6Molecular Weight: 973.369560 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 6

InChIKey: UOEYZAXKBKAKRO-UHFFFAOYSA-N

• 2-Amino-5-tert-butyl-1,3,4-thiadiazole
IUPAC Name: 5-tert-butyl-1,3,4-thiadiazol-2-amine | CAS Registry Number: 39222-73-6
Synonyms: Enamine_005678, 524409_ALDRICH, ZERO/005496, ALBB-000319, EINECS 254-364-2, ZINC03882373, 5-tert-Butyl-1,3,4-thiadiazol-2-amine, IDI1_007913, 1,3,4-Thiadiazol-2-amine, 5-(1,1-dimethylethyl)-

Molecular Formula: C6H11N3SMolecular Weight: 157.236640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: ICXDPEFCLDSXLI-UHFFFAOYSA-N

• 2-Chloropropionyl Chloride
IUPAC Name: 2-chloropropanoyl chloride | CAS Registry Number: 7623-09-8
Synonyms: 2-Chloropropionyl chloride, .alpha.-Chloropropionyl chloride, Propanoyl chloride, 2-chloro-, 157139_ALDRICH, 26200_FLUKA, EINECS 231-540-7, 76248-57-2

Molecular Formula: C3H4Cl2OMolecular Weight: 126.969260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: JEQDSBVHLKBEIZ-UHFFFAOYSA-N

• 2,6-Dichlorostyrene
IUPAC Name: 1,3-dichloro-2-ethenylbenzene | CAS Registry Number: 28469-92-3
Synonyms: 2,6-DICHLOROSTYRENE, 2,6-Dichlorovinylbenzene, D74509_ALDRICH, Benzene, 1,3-dichloro-2-ethenyl-, NSC89716, CID34254, EINECS 249-039-7, LS-191084, InChI=1/C8H6Cl2/c1-2-6-7(9)4-3-5-8(6)10/h2-5H,1H

Molecular Formula: C8H6Cl2Molecular Weight: 173.039240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: YJCVRMIJBXTMNR-UHFFFAOYSA-N

• 2,6-Di-Tert-Butyl-4-Methylphenyldiazo Acetate
IUPAC Name: (Z)-2-diazonio-1-(2,6-ditert-butyl-4-methylphenoxy)ethenolate | CAS Registry Number: 125640-92-8
Synonyms: 2,6-DI-TERT-BUTYL-4-METHYLPHENYLDIAZO ACETATE

Molecular Formula: C17H24N2O2Molecular Weight: 288.384660 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: JWOHWTRHFIOQSH-UVTDQMKNSA-N

• 4-Bromo Benzyl Alcohol
IUPAC Name: (4-bromophenyl)methanol | CAS Registry Number: 873-75-6
Synonyms: 4-Bromobenzyl alcohol, p-Bromobenzyl alcohol, (4-Bromophenyl)methanol, Para-Bromobenzyl Alcohol, p-Bromo-benzyl alcohol, Benzyl alcohol, p-bromo-, Benzenemethanol, 4-bromo-, CCRIS 5119, 187054_ALDRICH, 16458_FLUKA, EINECS 212-851-7, AIDS017546, AIDS-017546, ZINC00404753, DB02822, LS-188207, ST5406657, TL8005672, BRB

Molecular Formula: C7H7BrOMolecular Weight: 187.033880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: VEDDBHYQWFOITD-UHFFFAOYSA-N

• 6-Amino-2-naphthoic acid
IUPAC Name: 6-aminonaphthalene-2-carboxylate | CAS Registry Number: 116668-47-4
Synonyms: ZINC00403329, CID6951172

Molecular Formula: C11H8NO2-Molecular Weight: 186.186720 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: NZTPZUIIYNYZKT-UHFFFAOYSA-M

• 5-Bromo-2-hydroxybenzonitrile
IUPAC Name: 5-bromo-2-hydroxybenzonitrile | CAS Registry Number: 40530-18-5
Synonyms: ZINC02516785, EINECS 254-958-1, CID2757014, ST5165651

Molecular Formula: C7H4BrNOMolecular Weight: 198.016760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: PVCONXMDUZOPJH-UHFFFAOYSA-N

• 2,3-Dibromothiophene
IUPAC Name: 2,3-dibromothiophene | CAS Registry Number: 3140-93-0
Synonyms: Thiophene, 2,3-dibromo-, D43905_ALDRICH, 2,3-DIBROMOTHIOPHENE, TECH, NSC99003, EINECS 221-542-6, NSC 99003, ZINC04262021, Thiophene, 2,3-dibromo- (8CI)(9CI), ST5319390, TL8002399

Molecular Formula: C4H2Br2SMolecular Weight: 241.931680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: ATRJNSFQBYKFSM-UHFFFAOYSA-N

• 3-Bromo-2-chlorothiophene
IUPAC Name: 3-bromo-2-chlorothiophene | CAS Registry Number: 40032-73-3
Synonyms: 512389_ALDRICH, ZINC01023254, ST5405450, InChI=1/C4H2BrClS/c5-3-1-2-7-4(3)6/h1-2

Molecular Formula: C4H2BrClSMolecular Weight: 197.480680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: KSHOQKKCPJELBV-UHFFFAOYSA-N

• 5-Bromo Salicyl alcohol
IUPAC Name: 4-bromo-2-(hydroxymethyl)phenol | CAS Registry Number: 2316-64-5
Synonyms: Bromosaligenin, Bromsalizol, 5-Bromosaligenin, 5-Bromosalicyl alcohol, 5-bromosalicyl alcohol, 5-Bromo-2-hydroxybenzyl alcohol, 197009_ALDRICH, Benzyl alcohol, 5-bromo-2-hydroxy-, Benzenemethanol, 5-bromo-2-hydroxy-, NSC13010, EINECS 219-026-0, ZINC00159251, ST5307713, TL8007345, InChI=1/C7H7BrO2/c8-6-1-2-7(10)5(3-6)4-9/h1-3,9-10H,4H

Molecular Formula: C7H7BrO2Molecular Weight: 203.033280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: KNKRHSVKIORZQB-UHFFFAOYSA-N

• 2-Aminoindan Hydrochloride
IUPAC Name: 2,3-dihydro-1H-inden-2-amine chloride | CAS Registry Number: 2338-18-3
Synonyms: Indan-2-ylamine; hydrochloride, CHEBI:372625, NSC48663, NSC78117

Molecular Formula: C9H11ClN-Molecular Weight: 168.643340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: XEHNLVMHWYPNEQ-UHFFFAOYSA-M


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