Benzene and substituted derivatives
2-Bromo-1,3,5-trifluorobenzene, 98+%
CAS: 2367-76-2 Molecular Formula: C6H2BrF3 Molecular Weight (g/mol): 210.98 MDL Number: MFCD00000334 InChI Key: PZBSPSOGEVCRQI-UHFFFAOYSA-N Synonym: 1-bromo-2,4,6-trifluorobenzene,2,4,6-trifluorobromobenzene,2-bromo-1,3,5-trifluoro-benzene,benzene, 2-bromo-1,3,5-trifluoro,1-bromo-2,4,6-trifluoro benzene,1,3,5-trifluoro-2-bromobenzene,fr cf ef be,pubchem4306,acmc-1cbzk,intermediates-zcf02629 PubChem CID: 75398 IUPAC Name: 2-bromo-1,3,5-trifluorobenzene SMILES: FC1=CC(F)=C(Br)C(F)=C1
Ethyl 2-nitrobenzoate, 97%
CAS: 610-34-4 Molecular Formula: C9H9NO4 Molecular Weight (g/mol): 195.17 MDL Number: MFCD00014696 InChI Key: CPNMAYYYYSWTIV-UHFFFAOYSA-N Synonym: ethyl o-nitrobenzoate,ethyl nitrobenzoate,benzoic acid, o-nitro-, ethyl ester,benzoic acid, 2-nitro-, ethyl ester,nitrobenzoesaureathylester,acmc-1aul6,2-nitro-benzoic acid ethyl ester PubChem CID: 69123 IUPAC Name: ethyl 2-nitrobenzoate SMILES: CCOC(=O)C1=CC=CC=C1[N+]([O-])=O
2,3,4,5,6-Pentafluorophenylacetic acid, 98+%
CAS: 653-21-4 Molecular Formula: C8H3F5O2 Molecular Weight (g/mol): 226.102 MDL Number: MFCD00004316 InChI Key: LGCODSNZJOVMHV-UHFFFAOYSA-N Synonym: pentafluorophenylacetic acid,2,3,4,5,6-pentafluorophenylacetic acid,pentafluorophenyl acetic acid,2-perfluorophenyl acetic acid,2-2,3,4,5,6-pentafluorophenyl acetic acid,2,3,4,5,6-pentafluorphenylacetic acid,benzeneacetic acid, 2,3,4,5,6-pentafluoro,acmc-20aoj2,pentafluorophenylaceticacid,2-pentafluorophenyl acetic acid PubChem CID: 69553 IUPAC Name: 2-(2,3,4,5,6-pentafluorophenyl)acetic acid SMILES: C(C1=C(C(=C(C(=C1F)F)F)F)F)C(=O)O
4-Cyanobenzaldehyde, 98%
CAS: 105-07-7 Molecular Formula: C8H5NO Molecular Weight (g/mol): 131.13 MDL Number: MFCD00003376 InChI Key: WZWIQYMTQZCSKI-UHFFFAOYSA-N Synonym: 4-cyanobenzaldehyde,benzonitrile, 4-formyl,p-cyanobenzaldehyde,p-formylbenzonitrile,benzaldehyde, p-cyano,benzonitrile, p-formyl,usaf kf-1,terephthalaldehydonitrile,p-cyanobenzenecarboxaldehyde,4-formyl-benzonitrile PubChem CID: 66042 IUPAC Name: 4-formylbenzonitrile SMILES: O=CC1=CC=C(C=C1)C#N
2-Iodo-1,3,5-trimethylbenzene, 98%
CAS: 4028-63-1 Molecular Formula: C9H11I Molecular Weight (g/mol): 246.091 MDL Number: MFCD00013707 InChI Key: GTPNXFKONRIHRW-UHFFFAOYSA-N Synonym: 2,4,6-trimethyliodobenzene,2-iodomesitylene,mesityl iodide,benzene, 2-iodo-1,3,5-trimethyl,iodo-2,4,6-trimethylbenzene,2,4,6-trimethyliodobenzene 2-iodomesitylene,iodomesitylene,jodmesitylen,mesityliodine,pubchem12601 PubChem CID: 77647 IUPAC Name: 2-iodo-1,3,5-trimethylbenzene SMILES: CC1=CC(=C(C(=C1)C)I)C
2-Fluorophenyl isothiocyanate, 97%
CAS: 38985-64-7 Molecular Formula: C7H4FNS Molecular Weight (g/mol): 153.17 MDL Number: MFCD00004800 InChI Key: OAGDRIUTLPDSMJ-UHFFFAOYSA-N Synonym: 2-fluorophenyl isothiocyanate,o-fluorophenyl isothiocyanate,benzene, 1-fluoro-2-isothiocyanato,2-fluorophenylisothiocyanate,1-fluoro-2-isothiocyanato-benzene,isothiocyanic acid 2-fluorophenyl ester,benzene,1-fluoro-2-isothiocyanato,o-fluoro phenyl isothiocyanate,2-fluorobenzenisothiocyanate,timtec-bb sbb006546 PubChem CID: 97520 IUPAC Name: 1-fluoro-2-isothiocyanatobenzene SMILES: FC1=CC=CC=C1N=C=S
(R)-(+)-4-(Diphenylmethyl)-2-oxazolidinone, 97%
CAS: 173604-33-6 Molecular Formula: C16H15NO2 Molecular Weight (g/mol): 253.301 MDL Number: MFCD01863565 InChI Key: QEOCTJMBYZNEJH-AWEZNQCLSA-N Synonym: r-4-benzhydryloxazolidin-2-one,r-+-4-diphenylmethyl-2-oxazolidinone,r-4-methyldiphenyl-2-oxazolidinone,4r-4-diphenylmethyl-1,3-oxazolidin-2-one,pubchem11686,4r-4-benzhydryloxazolidine-2-one,r-4-diphenylmethyl oxazolidin-2-one,2-oxazolidinone,4-diphenylmethyl-, 4r,2-oxazolidinone, 4-diphenylmethyl-, 4r,r-+-4-diphenylmethyl-2-oxazolidin PubChem CID: 9837924 IUPAC Name: (4R)-4-benzhydryl-1,3-oxazolidin-2-one SMILES: C1C(NC(=O)O1)C(C2=CC=CC=C2)C3=CC=CC=C3
Methyl 3-hydroxy-4-nitrobenzoate, 98%
CAS: 713-52-0 Molecular Formula: C8H7NO5 Molecular Weight (g/mol): 197.146 MDL Number: MFCD00016997 InChI Key: UEGCRFNWTGYVKX-UHFFFAOYSA-N Synonym: benzoic acid, 3-hydroxy-4-nitro-, methyl ester,3-hydroxy-4-nitrobenzoic acid methyl ester,3-hydroxy-4-nitro-benzoic acid methyl ester,methyl 3-hydroxy-4-nitro-benzoate,methyl3-hydroxy-4-nitrobenzoate,pubchem20121,acmc-209oia,ksc379e5n,5-methoxycarbonyl-2-nitrophenol,methyl3-hydroxy-4-nitronemzoate PubChem CID: 294866 IUPAC Name: methyl 3-hydroxy-4-nitrobenzoate SMILES: COC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])O
3-Chloro-4-methylaniline, 98%
CAS: 95-74-9 Molecular Formula: C7H8ClN Molecular Weight (g/mol): 141.598 MDL Number: MFCD00007773 InChI Key: RQKFYFNZSHWXAW-UHFFFAOYSA-N Synonym: 3-chloro-p-toluidine,2-chloro-4-aminotoluene,4-amino-2-chlorotoluene,benzenamine, 3-chloro-4-methyl,3-chloro-4-methylbenzenamine,3-chloro-4-methylphenylamine,1-amino-3-chloro-4-methylbenzene,4-methyl-3-chloroaniline,p-toluidine, 3-chloro,gull toxicant PubChem CID: 7255 ChEBI: CHEBI:37824 IUPAC Name: 3-chloro-4-methylaniline SMILES: CC1=C(C=C(C=C1)N)Cl
(+/-)-Mandelamide, 97%
CAS: 4410-31-5 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.165 MDL Number: MFCD00025495 InChI Key: MAGPZHKLEZXLNU-UHFFFAOYSA-N Synonym: mandelamide,dl-mandelamide,o-hydroxy phenylacetamide,2-hydroxy-2-phenyl-acetamide,benzeneacetamide, .alpha.-hydroxy,hydrate,-mandelamide,mandelic acid amide,+/--mandelamide PubChem CID: 73558 IUPAC Name: 2-hydroxy-2-phenylacetamide SMILES: C1=CC=C(C=C1)C(C(=O)N)O
2-Bromobenzylamine, 98%
CAS: 3959-05-5 Molecular Formula: C7H8BrN Molecular Weight (g/mol): 186.05 MDL Number: MFCD00025572 InChI Key: NOYASZMZIBFFNZ-UHFFFAOYSA-N Synonym: 2-bromobenzylamine,2-bromophenyl methanamine,o-bromobenzylamine,2-bromophenyl methylamine,1-2-bromophenyl methanamine,2-brobenzylamine,2-bromo-benzylamine,pubchem20398,acmc-1ct06,benzenemethanamine, 2-bromo PubChem CID: 334072 IUPAC Name: (2-bromophenyl)methanamine SMILES: C1=CC=C(C(=C1)CN)Br
2,3,4,5,6-Pentafluorobenzyl alcohol, 98%
CAS: 440-60-8 Molecular Formula: C7H3F5O Molecular Weight (g/mol): 198.092 MDL Number: MFCD00004602 InChI Key: PGJYYCIOYBZTPU-UHFFFAOYSA-N Synonym: 2,3,4,5,6-pentafluorobenzyl alcohol,pentafluorobenzyl alcohol,perfluorophenyl methanol,pentafluorophenyl methanol,2,3,4,5,6-pentafluorophenyl methanol,2,3,4,5,6-pentafluorobenzenemethanol,hydroxymethyl pentafluorobenzene,benzenemethanol, 2,3,4,5,6-pentafluoro,pentafluorobenzylalcohol,2,3,4,5,6-pentafluorobenzylalcohol PubChem CID: 9923 ChEBI: CHEBI:44903 IUPAC Name: (2,3,4,5,6-pentafluorophenyl)methanol SMILES: C(C1=C(C(=C(C(=C1F)F)F)F)F)O
4,4'-Dimethylbenzophenone, 98+%
CAS: 611-97-2 Molecular Formula: C15H14O Molecular Weight (g/mol): 210.28 MDL Number: MFCD00017214 InChI Key: ZWPWLKXZYNXATK-UHFFFAOYSA-N Synonym: 4,4'-dimethylbenzophenone,p-tolyl ketone,bis 4-methylphenyl methanone,di-p-tolyl ketone,methanone, bis 4-methylphenyl,p,p'-dimethylbenzophenone,p,p'-dimethyl di-phenyl ketone,bis-p-tolylmethanone,benzophenone, 4,4'-dimethyl,4,4-dimethylbenzophenone PubChem CID: 69148 IUPAC Name: bis(4-methylphenyl)methanone SMILES: CC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C
1-Bromo-4-n-octylbenzene, 97%
CAS: 51554-93-9 Molecular Formula: C14H21Br Molecular Weight (g/mol): 269.226 MDL Number: MFCD00038348 InChI Key: OOZQSVXPBCINJF-UHFFFAOYSA-N Synonym: 1-4-bromophenyl octane,1-bromo-4-n-octylbenzene,p-octylbromobenzene,p-bromophenyloctane,4-n-octylbromobenzene,1-p-bromophenyl octane,4-bromooctylbenzene,4-oct-1-yl bromobenzene,benzene, 1-bromo-4-octyl,4-bromo-1-octylbenzene PubChem CID: 142854 IUPAC Name: 1-bromo-4-octylbenzene SMILES: CCCCCCCCC1=CC=C(C=C1)Br
n-Butyl 4-hydroxybenzoate, 99+%
CAS: 94-26-8 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00016478 InChI Key: QFOHBWFCKVYLES-UHFFFAOYSA-N Synonym: butylparaben,butyl paraben,butyl p-hydroxybenzoate,nipabutyl,butoben,butyl chemosept,butyl parasept,butyl tegosept,butyl butex,tegosept butyl PubChem CID: 7184 IUPAC Name: butyl 4-hydroxybenzoate SMILES: CCCCOC(=O)C1=CC=C(C=C1)O