Benzene and substituted derivatives
Ethyl 3-cyano-3-phenylpyruvate, 97%
CAS: 6362-63-6 Molecular Formula: C12H11NO3 Molecular Weight (g/mol): 217.22 MDL Number: MFCD00019801 InChI Key: YWNRATDDUSMBPR-UHFFFAOYNA-N Synonym: ethyl 3-cyano-3-phenylpyruvate,ethyl phenylcyanopyruvate,cyanophenylpyruvic acid ethyl ester,ethyl cyanophenylpyruvate,ethyl alpha-cyanophenylpyruvate,pyruvic acid, cyanophenyl-, ethyl ester,ethyl .alpha.-cyanophenylpyruvate,wln: ncr x1v1uno2,4-10-00-03440 beilstein handbook reference,benzenepropanoic acid, .beta.-cyano-.alpha.-oxo-, ethyl ester PubChem CID: 22845 IUPAC Name: ethyl 3-cyano-2-oxo-3-phenylpropanoate SMILES: CCOC(=O)C(=O)C(C#N)C1=CC=CC=C1
4-Benzyloxyphenylhydrazine hydrochloride, 98%, Thermo Scientific Chemicals
CAS: 52068-30-1 Molecular Formula: C13H14N2O·HCl Molecular Weight (g/mol): 250.73 MDL Number: MFCD00137741 InChI Key: OVNUPJXMCMTQCN-UHFFFAOYSA-N Synonym: 4-benzyloxyphenylhydrazine hydrochloride,4-benzyloxy phenyl hydrazine hydrochloride,4-benzyloxyphenyl hydrazine hydrochloride,4-benzyloxy phenyl hydrazine monohydrochloride,4-benzyloxyphenyl hydrazine hcl,4-benzyloxyphenylhydrazine hcl,4-benzyloxyphenylhydrazinehydrochloride,4-phenylmethoxyphenyl hydrazine hydrochloride PubChem CID: 3016725 IUPAC Name: (4-phenylmethoxyphenyl)hydrazine;hydrochloride SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)NN.Cl
3-chloro-5-fluorobenzyl Bromide, 97%, Thermo Scientific™
CAS: 493024-39-8 Molecular Formula: C7H5BrClF Molecular Weight (g/mol): 223.47 MDL Number: MFCD03788472 InChI Key: PKSAHOPFPPAUOD-UHFFFAOYSA-N Synonym: 3-chloro-5-fluorobenzyl bromide,1-bromomethyl-3-chloro-5-fluorobenzene,3-chloro-5-fluorobenzylbromide,5-chloro-3-fluorobenzyl bromide,benzene, 1-bromomethyl-3-chloro-5-fluoro,5-bromomethyl-3-chloro-1-fluorobenzene,alpha-bromo-3-chloro-5-fluorotoluene,pubchem4896,acmc-209kfr,1-bromomethyl-3-chloro-5-fluoro-benzene PubChem CID: 2734834 IUPAC Name: 1-(bromomethyl)-3-chloro-5-fluorobenzene SMILES: FC1=CC(Cl)=CC(CBr)=C1
Benzophenone oxime, 98%
CAS: 574-66-3 Molecular Formula: C13H11NO Molecular Weight (g/mol): 197.24 MDL Number: MFCD00051461 InChI Key: DNYZBFWKVMKMRM-UHFFFAOYSA-N Synonym: benzophenone oxime,diphenylmethanone oxime,benzophenoxime,methanone, diphenyl-, oxime,diphenyl ketoxime,benzophenoneoxime,diphenylmethylene hydroxylamine,benzophenone, oxime,unii-2dlj8c37dq,diphenylketone oxime PubChem CID: 11324 IUPAC Name: N-benzhydrylidenehydroxylamine SMILES: ON=C(C1=CC=CC=C1)C1=CC=CC=C1
2-Chlorobenzoyl chloride, 97%
CAS: 609-65-4 Molecular Formula: C7H4Cl2O Molecular Weight (g/mol): 175.01 MDL Number: MFCD00000660 InChI Key: ONIKNECPXCLUHT-UHFFFAOYSA-N Synonym: benzoyl chloride, 2-chloro,o-chlorobenzoyl chloride,chlorobenzoyl chloride,benzoyl chloride, o-chloro,ococ,2-chloro-benzoyl chloride,unii-jr29a4n74x,o-chlorobenzoylchloride,2-chlorobenzoylchloride,2-chlorobenzoic acid chloride PubChem CID: 69110 ChEBI: CHEBI:60719 IUPAC Name: 2-chlorobenzoyl chloride SMILES: ClC(=O)C1=CC=CC=C1Cl
4-Fluorophenylhydrazine hydrochloride, 97%
CAS: 823-85-8 Molecular Formula: C6H8ClFN2 Molecular Weight (g/mol): 162.59 MDL Number: MFCD00012942 InChI Key: FEKUXLUOKFSMRO-UHFFFAOYSA-N Synonym: 4-fluorophenylhydrazine hydrochloride,4-fluorophenyl hydrazine hydrochloride,4-fluorophenylhydrazine hcl,1-4-fluorophenyl hydrazine hydrochloride,4-fluorophenyl hydrazine hcl,p-fluorophenylhydrazine hydrochloride,4-fluorphenyl hydrazine hydrochloride,4-fluorophenyl hydrazine monohydrochloride,p-fluorophenylhydrazine hcl,hydrazine, 4-fluorophenyl-, monohydrochloride PubChem CID: 69981 IUPAC Name: (4-fluorophenyl)hydrazine;hydrochloride SMILES: [H+].[Cl-].NNC1=CC=C(F)C=C1
5-Chloro-2-fluorobenzoic acid, 97%, Thermo Scientific™
CAS: 394-30-9 Molecular Formula: C7H4ClFO2 Molecular Weight (g/mol): 174.56 InChI Key: WGAVMKXCDMQVNF-UHFFFAOYSA-N Synonym: 2-fluoro-5-chlorobenzoic acid,5-chloro-2-fluoro-benzoic acid,5-chloro-2-fluorobenzoicacid,benzoic acid, 5-chloro-2-fluoro,pubchem1375,acmc-1aigz,ksc223m7h,rarechem al bo 0944,5-chloro-2-fluorobenzoic acid,benzoicacid, 5-chloro-2-fluoro PubChem CID: 2736537 IUPAC Name: 5-chloro-2-fluorobenzoic acid SMILES: C1=CC(=C(C=C1Cl)C(=O)O)F
3-Chloro-4-(trifluoromethyl)benzoic acid, 97%
CAS: 115754-20-6 Molecular Formula: C8H4ClF3O2 Molecular Weight (g/mol): 224.56 MDL Number: MFCD04972755 InChI Key: UDXPRKSPAZWHQN-UHFFFAOYSA-N Synonym: 3-chloro-4-trifluoromethyl benzoic acid,benzoic acid, 3-chloro-4-trifluoromethyl,3-chloro-4-trifluoromethyl-benzoic acid,acmc-1c5tn,chloro-4-trifluoromethyl benzoic acid,3-chloro-4-trifluoromethyl benzoic acid, jrd PubChem CID: 21180297 IUPAC Name: 3-chloro-4-(trifluoromethyl)benzoic acid SMILES: OC(=O)C1=CC(Cl)=C(C=C1)C(F)(F)F
4-(tert-Butyl)-2-chloroaniline, 95%, Thermo Scientific™
CAS: 42265-67-8 Molecular Formula: C10H14ClN Molecular Weight (g/mol): 183.68 MDL Number: MFCD00052272 InChI Key: MFEZEFHCSBXPPO-UHFFFAOYSA-N Synonym: 4-tert-butyl-2-chloroaniline,4-t-butyl-2-chloroaniline,2-chloro-4-tert-butylaniline,4-tert-butyl-2-chloro-aniline,aniline, 4-tert-butyl-2-chloro,4-tert-butyl-2-chlorophenylamine,benzenamine,2-chloro-4-1,1-dimethylethyl PubChem CID: 521094 IUPAC Name: 4-tert-butyl-2-chloroaniline SMILES: CC(C)(C)C1=CC(Cl)=C(N)C=C1
1-Bromo-2,3-difluorobenzene, 98%
CAS: 38573-88-5 Molecular Formula: C6H3BrF2 Molecular Weight (g/mol): 192.991 MDL Number: MFCD00061136 InChI Key: RKWWASUTWAFKHA-UHFFFAOYSA-N Synonym: 2,3-difluorobromobenzene,2,3-difluorobrmorobenzene,1-bromo-2,3-difluoro-benzene,3-bromo-1,2-difluorobenzene,difluorobromobenzene,pubchem1041,acmc-1aibi,2,3-diflurobromobenzene,2,3-difluorophenyl bromide,2,3-difluoro-1-bromobenzene PubChem CID: 2733260 IUPAC Name: 1-bromo-2,3-difluorobenzene SMILES: C1=CC(=C(C(=C1)Br)F)F
4-Methoxyphenylacetic acid, 99%
CAS: 104-01-8 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00004345 InChI Key: NRPFNQUDKRYCNX-UHFFFAOYSA-N Synonym: 4-methoxyphenylacetic acid,homoanisic acid,2-4-methoxyphenyl acetic acid,4-methoxybenzeneacetic acid,benzeneacetic acid, 4-methoxy,4-methoxyphenyl acetic acid,p-methoxyphenylacetic acid,2-p-anisyl acetic acid,p-methoxyphenyl acetic acid PubChem CID: 7690 ChEBI: CHEBI:55501 IUPAC Name: 2-(4-methoxyphenyl)acetic acid SMILES: COC1=CC=C(C=C1)CC(=O)O
3,5-Bis(trifluoromethyl)bromobenzene, 99%
CAS: 328-70-1 Molecular Formula: C8H3BrF6 Molecular Weight (g/mol): 293.01 InChI Key: CSVCVIHEBDJTCJ-UHFFFAOYSA-N Synonym: 3,5-bis trifluoromethyl bromobenzene,1-bromo-3,5-bis trifluoromethyl benzene,1,3-bis trifluoromethyl-5-bromobenzene,mbt-br,3,5-di trifluoromethyl bromobenzene,3,5-bis trifluoromethyl-1-bromobenzene,3,5-bis-trifluoromethylbromobenzene,benzene, 1-bromo-3,5-bis trifluoromethyl,3,5-bis trifluoromethyl phenyl bromide,1-bromo-3,5-bis-trifluoromethyl-benzene PubChem CID: 67602 IUPAC Name: 1-bromo-3,5-bis(trifluoromethyl)benzene SMILES: C1=C(C=C(C=C1C(F)(F)F)Br)C(F)(F)F
5-Iodo-1,2,3-trimethoxybenzene, 97%
CAS: 25245-29-8 Molecular Formula: C9H11IO3 Molecular Weight (g/mol): 294.09 MDL Number: MFCD01318153 InChI Key: IWPMQXOVTMABLF-UHFFFAOYSA-N Synonym: 3,4,5-trimethoxyiodobenzene,benzene, 5-iodo-1,2,3-trimethoxy,acmc-1cfcc,3,4,5-trimethoxy-iodobenzene,3,4,5-trimethoxyphenyl iodide,3,4,5-trimethoxy-iodo-benzene,1-iodo-3,4,5-trimethoxybenzene,1,2,3-trimethoxy-5-iodobenzene,5-iodo-1,2,3-trimethoxy-benzene,5-iodanyl-1,2,3-trimethoxy-benzene PubChem CID: 298133 IUPAC Name: 5-iodo-1,2,3-trimethoxybenzene SMILES: COC1=CC(I)=CC(OC)=C1OC
2,3-Dimethoxybenzoic acid, 99%
CAS: 1521-38-6 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.18 MDL Number: MFCD00002432 InChI Key: FODBVCSYJKNBLO-UHFFFAOYSA-N Synonym: o-veratric acid,benzoic acid, 2,3-dimethoxy,benzoic acid, dimethoxy,2,3-dimethoxy benzoic acid,dimethoxybenzoic acid,2,3,o-veratric acid 6ci,7ci,8ci,2,3-dimethoxybenzoicacid,dimethoxybenzoic acid,pubchem4948,2,3-dimethoxy-benzoicaci PubChem CID: 15204 IUPAC Name: 2,3-dimethoxybenzoic acid SMILES: COC1=CC=CC(C(O)=O)=C1OC
2,3,6-Trifluorobenzaldehyde, 97%, Thermo Scientific™
CAS: 104451-70-9 Molecular Formula: C7H3F3O Molecular Weight (g/mol): 160.10 MDL Number: MFCD00061195 InChI Key: XSBAHBVACIKRTG-UHFFFAOYSA-N Synonym: benzaldehyde, 2,3,6-trifluoro,2,3,6-trifluoro-benzaldehyde,pubchem1467,acmc-1bqm6,2,3,6-trifluorobenzoaldehyde,ksc494g2t,2,3,6-trifluoro benzaldehyde,timtec-bb sbb003970,attercop-chm at111497 PubChem CID: 517845 IUPAC Name: 2,3,6-trifluorobenzaldehyde SMILES: FC1=CC=C(F)C(C=O)=C1F