Benzene and substituted derivatives
2-Chloro-4-nitrotoluene, 98%
CAS: 121-86-8 Molecular Formula: C7H6ClNO2 Molecular Weight (g/mol): 171.58 MDL Number: MFCD00007210 InChI Key: LLYXJBROWQDVMI-UHFFFAOYSA-N Synonym: 2-chloro-4-nitrotoluene,benzene, 2-chloro-1-methyl-4-nitro,o-chloro-p-nitrotoluol,toluene, 2-chloro-4-nitro,3-chloro-4-methylnitrobenzene,2-chlor-4-nitrotoluen,unii-9t26lnr6t8,2-chloro-4-nitrotoluen czech,2,4-chloronitrotoluene,2-chloro-4-nitro-1-methylbenzene PubChem CID: 8491 IUPAC Name: 2-chloro-1-methyl-4-nitrobenzene SMILES: CC1=C(C=C(C=C1)[N+](=O)[O-])Cl
4,4'-Dimethoxydiphenylamine, 98%
CAS: 101-70-2 Molecular Formula: C14H15NO2 Molecular Weight (g/mol): 229.28 MDL Number: MFCD00014895 InChI Key: VCOONNWIINSFBA-UHFFFAOYSA-N Synonym: bis 4-methoxyphenyl amine,4,4'-dimethoxydiphenylamine,di-p-anisylamine,di-p-methoxyphenylamine,4-methoxy-n-4-methoxyphenyl aniline,bis p-anisyl amine,bis p-methoxyphenyl amine,benzenamine, 4-methoxy-n-4-methoxyphenyl,termofleks a,bis-4-methoxy-phenyl-amine PubChem CID: 7571 IUPAC Name: 4-methoxy-N-(4-methoxyphenyl)aniline SMILES: COC1=CC=C(NC2=CC=C(OC)C=C2)C=C1
(3-Pyrimidin-2-ylphenyl)methanol, 97%, Thermo Scientific™
CAS: 892502-12-4 Molecular Formula: C11H10N2O Molecular Weight (g/mol): 186.21 MDL Number: MFCD09064977 InChI Key: WMNXGJMCXOLBBV-UHFFFAOYSA-N Synonym: 3-pyrimidin-2-ylphenyl methanol,3-pyrimidin-2-yl phenyl methanol,benzenemethanol,3-2-pyrimidinyl,3-pyrimidin-2-yl-benzyl alcohol,benzenemethanol, 3-2-pyrimidinyl,3-pyrimidin-2-ylphenyl methan-1-ol PubChem CID: 24229565 SMILES: OCC1=CC=CC(=C1)C1=NC=CC=N1
tert-Butyl phenyl carbonate, 97%
CAS: 6627-89-0 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00008804 InChI Key: UXWVQHXKKOGTSY-UHFFFAOYSA-N Synonym: t-butyl phenyl carbonate,tert-butylphenylcarbonate,2-methyl-2-propanyl phenyl carbonate,carbonic acid, 1,1-dimethylethyl phenyl ester,pubchem13300,acmc-209nuo,phenyl t-butyl carbonate,uxwvqhxkkogtsy-uhfffaoysa,tert-butyl phenyl carbonate,carbonic acid tert-butylphenyl ester PubChem CID: 81113 IUPAC Name: tert-butyl phenyl carbonate SMILES: CC(C)(C)OC(=O)OC1=CC=CC=C1
Pentafluorobenzoyl chloride, 98%
CAS: 2251-50-5 Molecular Formula: C7ClF5O Molecular Weight (g/mol): 230.52 MDL Number: MFCD00000657 InChI Key: MYHOHFDYWMPGJY-UHFFFAOYSA-N Synonym: pentafluorobenzoyl chloride,perfluorobenzoyl chloride,benzoyl chloride, pentafluoro,pentafluorobenzoylchloride,pubchem15522,acmc-1covi,intermediates-zcf02601,pentafluorobenzoic acid chloride,attercop-chm at133861,67924-15-6 unspecified acetate PubChem CID: 75256 ChEBI: CHEBI:39425 IUPAC Name: 2,3,4,5,6-pentafluorobenzoyl chloride SMILES: FC1=C(F)C(F)=C(C(Cl)=O)C(F)=C1F
N-Benzylethanolamine, 96%
CAS: 104-63-2 Molecular Formula: C9H13NO Molecular Weight (g/mol): 151.21 MDL Number: MFCD00002840 InChI Key: XNIOWJUQPMKCIJ-UHFFFAOYSA-N Synonym: n-benzylethanolamine,2-benzylamino ethanol,benzylaminoethanol,benzylethanolamine,ethanol, 2-phenylmethyl amino,2-benzylamino ethan-1-ol,benzyl ethanolamine,n-benzyle ethanol amine,ethanol, 2-benzylamino,unii-48121ms9jm PubChem CID: 4348 IUPAC Name: 2-(benzylamino)ethanol SMILES: OCCNCC1=CC=CC=C1
4-Chlorobenzylamine, 97+%
CAS: 104-86-9 Molecular Formula: C7H8ClN Molecular Weight (g/mol): 141.598 MDL Number: MFCD00008121 InChI Key: YMVFJGSXZNNUDW-UHFFFAOYSA-N Synonym: 4-chlorobenzylamine,4-chlorophenyl methanamine,p-chlorobenzylamine,benzenemethanamine, 4-chloro,1-4-chlorophenyl methanamine,4-chloro-benzylamine,benzylamine, p-chloro,4-chlorophenyl methylamine,para-chlorobenzylamine,chembl13218 PubChem CID: 66036 IUPAC Name: (4-chlorophenyl)methanamine SMILES: C1=CC(=CC=C1CN)Cl
4-Methoxycarbonyl-2-nitrobenzeneboronic acid, 97%
CAS: 85107-55-7 Molecular Formula: C8H8BNO6 Molecular Weight (g/mol): 224.963 MDL Number: MFCD01632202 InChI Key: SFEJGHJCGQNFQC-UHFFFAOYSA-N Synonym: 4-methoxycarbonyl-2-nitrophenyl boronic acid,4-methoxycarbonyl-2-nitrophenylboronic acid,4-methoxycarbonyl-2-nitrobenzeneboronic acid,methyl 4-dihydroxyboranyl-3-nitrobenzoate,2-nitro-4-methoxycarbonyl phenylboronic acid,4-methoxycarbonyl-2-nitro-phenyl boronic acid,methyl 4-borono-3-nitrobenzoate,acmc-209q4d PubChem CID: 2773493 IUPAC Name: (4-methoxycarbonyl-2-nitrophenyl)boronic acid SMILES: B(C1=C(C=C(C=C1)C(=O)OC)[N+](=O)[O-])(O)O
4-Bromo-1,2-dichlorobenzene, 98+%
CAS: 18282-59-2 Molecular Formula: C6H3BrCl2 Molecular Weight (g/mol): 225.89 MDL Number: MFCD00040849 InChI Key: CFPZDVAZISWERM-UHFFFAOYSA-N Synonym: 1-bromo-3,4-dichlorobenzene,3,4-dichlorobromobenzene,benzene, 4-bromo-1,2-dichloro,3,4-dichlorophenyl bromide,3,4-dichloro-1-bromobenzene,4-bromo-1,2-dichloro-benzene,5-bromdichlorbenzol,pubchem3611,acmc-1btol,3,4-dichloro-bromobenzene PubChem CID: 29013 IUPAC Name: 4-bromo-1,2-dichlorobenzene SMILES: ClC1=CC=C(Br)C=C1Cl
3-(Dimethylamino)benzyl alcohol, 95%
CAS: 23501-93-1 Molecular Formula: C9H13NO Molecular Weight (g/mol): 151.21 MDL Number: MFCD00017342 InChI Key: YTUXZVSDDHCTBZ-UHFFFAOYSA-N Synonym: 3-dimethylamino phenyl methanol,3-dimethylamino benzyl alcohol,3-dimethylaminobenzyl alcohol,m-dimethylamino benzyl alcohol,benzenemethanol,3-dimethylamino,3-dimethylamino phenyl methan-1-ol,benzyl alcohol, m-dimethylamino,benzenemethanol, 3-dimethylamino PubChem CID: 90133 IUPAC Name: [3-(dimethylamino)phenyl]methanol SMILES: CN(C)C1=CC=CC(=C1)CO
3,5-Bis(trifluoromethyl)benzyl bromide, 97%
CAS: 32247-96-4 Molecular Formula: C9H5BrF6 Molecular Weight (g/mol): 307.03 MDL Number: MFCD00009905 InChI Key: ATLQGZVLWOURFU-UHFFFAOYSA-N Synonym: 3,5-bis trifluoromethyl benzyl bromide,1-bromomethyl-3,5-bis trifluoromethyl benzene,3,5-di trifluoromethyl benzyl bromide,3,5-bis trifluoromethyl benzylbromide,1-bromomethyl-3,5-di trifluoromethyl benzene,3,5-bis-trifluoromethyl benzyl bromide,benzene, 1-bromomethyl-3,5-bis trifluoromethyl,1,3-bis trifluoromethyl-5-bromomethyl benzene PubChem CID: 122573 IUPAC Name: 1-(bromomethyl)-3,5-bis(trifluoromethyl)benzene SMILES: FC(F)(F)C1=CC(=CC(CBr)=C1)C(F)(F)F
2,4-Dimethylbenzaldehyde, 90+%
CAS: 15764-16-6 Molecular Formula: C9H10O Molecular Weight (g/mol): 134.178 MDL Number: MFCD00003340 InChI Key: GISVICWQYMUPJF-UHFFFAOYSA-N Synonym: benzaldehyde, 2,4-dimethyl,2,4-dimethyl benzaldehyde,2,4-xylylaldehyde,2,4-dimethylbenzenecarboxaldehyde,unii-i06yu18h4a,1-formyl-2,4-dimethylbenzene,2,4-dimethyl-benzaldehyde,m-xylylaldehyde,fema no. 3427,2,4-trimethyl benzaldehyde PubChem CID: 61814 IUPAC Name: 2,4-dimethylbenzaldehyde SMILES: CC1=CC(=C(C=C1)C=O)C
3-Methylsulphonylbenzoic acid, 95%, Thermo Scientific™
CAS: 5345-27-7 Molecular Formula: C8H8O4S Molecular Weight (g/mol): 200.22 MDL Number: MFCD00216488 InChI Key: KUTBMATZUQWFSR-UHFFFAOYSA-N Synonym: 3-methylsulfonyl benzoic acid,3-methylsulphonyl benzoic acid,3-methylsulphonylbenzoic acid,3-methanesulfonylbenzoic acid,3-methanesulfonyl-benzoic acid,benzoic acid, 3-methylsulfonyl,3-mesylbenzoic acid,pubchem10870,acmc-1auq1 PubChem CID: 220380 IUPAC Name: 3-methylsulfonylbenzoic acid SMILES: CS(=O)(=O)C1=CC=CC(=C1)C(=O)O
Methyl benzoylformate, 99%
CAS: 15206-55-0 Molecular Formula: C9H8O3 Molecular Weight (g/mol): 164.16 MDL Number: MFCD00008443 InChI Key: YLHXLHGIAMFFBU-UHFFFAOYSA-N Synonym: methyl benzoylformate,methyl phenylglyoxylate,methyl oxophenylacetate,methyl phenylglyoxalate,benzoylformic acid methyl ester,methylbenzoylformate,phenylglyoxylic acid methyl ester,phenylglyoxylic acid, methyl ester,benzeneacetic acid, .alpha.-oxo-, methyl ester,unii-23f2045stg PubChem CID: 84835 ChEBI: CHEBI:84256 IUPAC Name: methyl 2-oxo-2-phenylacetate SMILES: COC(=O)C(=O)C1=CC=CC=C1
