Benzenoids
Glimepiride
CAS: 93479-97-1 Molecular Formula: C24H34N4O5S Molecular Weight (g/mol): 490.62 MDL Number: MFCD00878417 InChI Key: WIGIZIANZCJQQY-UHFFFAOYSA-N Synonym: glimepiride,amaryl,glimepiridum,glimepirida,amarel,glimepirid,glimepride,endial,roname,glimepiridum latin PubChem CID: 3476 IUPAC Name: 3-ethyl-4-methyl-N-{2-[4-({[(4-methylcyclohexyl)carbamoyl]amino}sulfonyl)phenyl]ethyl}-2-oxo-2,5-dihydro-1H-pyrrole-1-carboxamide SMILES: CCC1=C(C)CN(C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)NC(=O)NC2CCC(C)CC2)C1=O
5-Bromo-2-chlorophenol, 98+%
CAS: 183802-98-4 Molecular Formula: C6H4BrClO Molecular Weight (g/mol): 207.451 MDL Number: MFCD00672940 InChI Key: UEVFFMZHGNYDKM-UHFFFAOYSA-N Synonym: 2-chloro-5-bromophenol,5-bromo-2-chloro-phenol,phenol, 5-bromo-2-chloro,pubchem1476,acmc-1bxbv,3-bromo-6-chlorophenol,5-bromo-2-chloro phenol,ksc174k5h PubChem CID: 820392 IUPAC Name: 5-bromo-2-chlorophenol SMILES: C1=CC(=C(C=C1Br)O)Cl
4-Chloro-3-nitrobenzophenone, 99%
CAS: 56107-02-9 Molecular Formula: C13H8ClNO3 Molecular Weight (g/mol): 261.66 MDL Number: MFCD00007081 InChI Key: YBDBYPQFIMSFJW-UHFFFAOYSA-N Synonym: 4-chloro-3-nitrobenzophenone,methanone, 4-chloro-3-nitrophenyl phenyl,benzophenone, 4-chloro-3-nitro,4-chloro-3-nitrophenyl phenyl methanone,3-nitro-4-chlorobenzophenone,chembl53270,4-chloro-3-nitrophenyl-phenylmethanone,4-chloro-3-nitro-phenyl-phenyl-methanone,4-chloro-3-nitrophenyl phenyl ketone,acmc-20amlb PubChem CID: 41743 IUPAC Name: (4-chloro-3-nitrophenyl)-phenylmethanone SMILES: [O-][N+](=O)C1=CC(=CC=C1Cl)C(=O)C1=CC=CC=C1
N-Boc-4-bromoaniline, 97%
CAS: 131818-17-2 Molecular Formula: C11H14BrNO2 Molecular Weight (g/mol): 272.14 MDL Number: MFCD01006612 InChI Key: VLGPDTPSKUUHKR-UHFFFAOYSA-N Synonym: tert-butyl 4-bromophenyl carbamate,tert-butyl n-4-bromophenyl carbamate,tert-butyl 4-bromophenylcarbamate,n-boc-4-bromoaniline,n-tert-butoxycarbonyl-4-bromoaniline,metronidazolebenzoate,n-boc 4-bromoaniline,4-bromo-n-boc aniline,acmc-1c4z5,t-butyl 4-bromophenylcarbamate PubChem CID: 2773608 IUPAC Name: tert-butyl N-(4-bromophenyl)carbamate SMILES: CC(C)(C)OC(=O)NC1=CC=C(Br)C=C1
Di-n-propyl phthalate, 98%
CAS: 131-16-8 Molecular Formula: C14H18O4 Molecular Weight (g/mol): 250.294 MDL Number: MFCD00009371 InChI Key: MQHNKCZKNAJROC-UHFFFAOYSA-N Synonym: dipropyl phthalate,di-n-propyl phthalate,di-n-propylphthalate,phthalic acid dipropyl ester,phthalic acid, dipropyl ester,phthalic acid di-n-propyl ester,1,2-benzenedicarboxylic acid, dipropyl ester,dipropylphthalate,n-dipropyl phthalate,unii-8usp5y77ss PubChem CID: 8559 ChEBI: CHEBI:60069 IUPAC Name: dipropyl benzene-1,2-dicarboxylate SMILES: CCCOC(=O)C1=CC=CC=C1C(=O)OCCC
3-Bromo-5-fluorobenzonitrile, 98%
CAS: 179898-34-1 Molecular Formula: C7H3BrFN Molecular Weight (g/mol): 200.01 MDL Number: MFCD04038227 InChI Key: IADLVSLZPQYXIF-UHFFFAOYSA-N Synonym: 3-fluoro-5-bromobenzonitrile,benzonitrile, 3-bromo-5-fluoro,5-bromo-3-fluorobenzenecarbonitrile,3-cyano-5-fluorobromobenzene,3-bromo 5-fluorobenzonitrile,3-bromo-5-fluoro-benzonitrile,3-bromo-5-fluorobenzenecarbonitrile,pubchem3220,acmc-209yem,3-fluoro-5-bromobenzonitile PubChem CID: 2783330 IUPAC Name: 3-bromo-5-fluorobenzonitrile SMILES: FC1=CC(Br)=CC(=C1)C#N
Bis(p-toluenesulfonyl)methane, 97%
CAS: 15310-28-8 Molecular Formula: C15H16O4S2 Molecular Weight (g/mol): 324.41 MDL Number: MFCD00032255 InChI Key: XLOXYWLRAKCDQL-UHFFFAOYSA-N Synonym: ditosylmethane,bis-toluene-4-sulfonyl-methane,1-methyl-4-4-methylbenzenesulfonyl methanesulfonyl benzene,1,1'-methanediyldisulfonyl bis 4-methylbenzene,acmc-20allu,bis p-tolylsulfonyl methane,bis p-toluenesulfonyl methane,bis-toluene-4-sulfonyl methane,1,1'-methylenedisulfonyl bis 4-methylbenzene,benzene,1,1'-methylenebis sulfonyl bis 4-methyl PubChem CID: 275690 IUPAC Name: 1-methyl-4-[(4-methylphenyl)sulfonylmethylsulfonyl]benzene SMILES: CC1=CC=C(C=C1)S(=O)(=O)CS(=O)(=O)C1=CC=C(C)C=C1
4-Cyanobiphenyl, 95%
CAS: 2920-38-9 Molecular Formula: C13H9N Molecular Weight (g/mol): 179.22 MDL Number: MFCD00001821 InChI Key: BPMBNLJJRKCCRT-UHFFFAOYSA-N Synonym: 4-cyanobiphenyl,1,1'-biphenyl-4-carbonitrile,4-biphenylcarbonitrile,p-phenylbenzonitrile,p-cyanobiphenyl,biphenyl-4-carbonitrile,4-phenylbenzenecarbonitrile,4-biphenylcarboxylic acid nitrile,4-cyanodiphenyl PubChem CID: 18021 IUPAC Name: 4-phenylbenzonitrile SMILES: N#CC1=CC=C(C=C1)C1=CC=CC=C1
2-Fluoro-6-nitrobenzoic acid, 98%
CAS: 385-02-4 Molecular Formula: C7H4FNO4 Molecular Weight (g/mol): 185.11 MDL Number: MFCD01862079 InChI Key: MPDZCNPDHUUPRL-UHFFFAOYSA-N Synonym: 2-fluoro-6-nitrobenzoic acid,2-fluoro-6-nitrobenzoicacid,6-fluoro-2-nitrobenzoic acid,2-carboxy-3-fluoronitrobenzene,2-fluoro-6-nitro-benzoic acid,benzoic acid, 2-fluoro-6-nitro,pubchem1308,6-fluoro-nitrobenzoic acid,acmc-209j0j,ksc222c6b PubChem CID: 603758 SMILES: C1=CC(=C(C(=C1)F)C(=O)O)[N+](=O)[O-]
4-Amino-3-fluorophenol, 98%
CAS: 399-95-1 Molecular Formula: C6H6FNO Molecular Weight (g/mol): 127.12 InChI Key: MNPLTKHJEAFOCA-UHFFFAOYSA-N Synonym: 3-fluoro-4-aminophenol,2-fluoro-4-hydroxyaniline,phenol, 4-amino-3-fluoro,4-amino-3-fluoro-phenol,pubchem2832,3-fluoro-4-amino-phenol,4-amino-3-fluorophenol,acmc-209j9q,4-amine-3-fluorophenol,buttpark 33\04-79 PubChem CID: 2735919 IUPAC Name: 4-amino-3-fluorophenol SMILES: C1=CC(=C(C=C1O)F)N
N-Fmoc-L-alanine monohydrate, 98%
CAS: 207291-76-7 Molecular Formula: C18H19NO5 Molecular Weight (g/mol): 329.35 MDL Number: MFCD00037139 InChI Key: GAPWKFLOMOFHGO-UHFFFAOYNA-N Synonym: n-fmoc-l-alanine hydrate,n-fmoc-l-alanine monohydrate,n-9h-fluoren-9-ylmethoxy carbonyl-l-alanine hydrate,n-fmoc-l-alanine,2s-2-fluoren-9-ylmethoxy carbonylamino propanoic acid, hydrate,2s-2-9h-fluoren-9-ylmethoxy carbonyl amino propanoic acid hydrate,fmoc-ala-oh h2o,fmoc-ala-oh.h2o,fmoc-l-alanine hydrate,n-9-fluorenylmethoxycarbonyl-l-alanine monohydrate PubChem CID: 18528118 IUPAC Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid;hydrate SMILES: O.CC(NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12)C(O)=O
4-Hydroxy-3-nitrophenylacetic acid, 99%, Thermo Scientific™
CAS: 10463-20-4 Molecular Formula: C8H7NO5 Molecular Weight (g/mol): 197.15 InChI Key: QBHBHOSRLDPIHG-UHFFFAOYSA-N Synonym: 4-hydroxy-3-nitrophenylacetic acid,2-4-hydroxy-3-nitrophenyl acetic acid,4-hydroxy-3-nitrophenyl acetic acid,3-nitro-4-hydroxyphenylacetic acid,3-nitro-4-hydroxy phenylacetic acid,benzeneacetic acid, 4-hydroxy-3-nitro,no2hpa,hydroxynitrophenylaceticacid,acmc-2098cj,epitope id:158629 PubChem CID: 447364 ChEBI: CHEBI:546274 SMILES: C1=CC(=C(C=C1CC(=O)O)[N+](=O)[O-])O
5-Fluoro-2-iodoaniline, 97%
CAS: 255724-71-1 Molecular Formula: C6H5FIN Molecular Weight (g/mol): 237.02 MDL Number: MFCD02093953 InChI Key: UCPDOOZBROQHME-UHFFFAOYSA-N Synonym: benzenamine, 5-fluoro-2-iodo,5-fluoro-2-iodo-aniline,5-fluoro-2-iodo-phenylamine,2-iodo-5-fluoroaniline,5-fluoro-2-iodophenylamine,pubchem1535,acmc-20a2iw,3-fluoro-6-iodoaniline,intermediates-zcf02682,5-fluoro-2-iodobenzenamine PubChem CID: 2774512 IUPAC Name: 5-fluoro-2-iodoaniline SMILES: NC1=C(I)C=CC(F)=C1
p-Iodonitrotetazolium violet, 100.7%, MP Biomedicals™
CAS: 146-68-9 Molecular Formula: C19H13ClIN5O2 Molecular Weight (g/mol): 505.70 MDL Number: MFCD00011961,MFCD00149999 InChI Key: JORABGDXCIBAFL-UHFFFAOYSA-M Synonym: iodonitrotetrazolium chloride,iodonitrotetrazolium,iodonitrotetrazolium purple,iodonitrotetrazolium violet,2-4-iodophenyl-3-4-nitrophenyl-5-phenyltetrazolium chloride,iodonitro tetrazolium,int,p-iodonitrotetrazolium violet,int chemical,2-p-iodophenyl-3-p-nitrophenyl-5-phenyltetrazolium chloride PubChem CID: 64957 ChEBI: CHEBI:75421 IUPAC Name: 3-(4-iodophenyl)-2-(4-nitrophenyl)-5-phenyl-3H-1,2λ⁵,3,4-tetrazol-2-ylium chloride SMILES: [Cl-].[O-][N+](=O)C1=CC=C(C=C1)[N+]1=NC(=NN1C1=CC=C(I)C=C1)C1=CC=CC=C1