Benzenoids
Rosin, Gum, MP Biomedicals™
CAS: 8050-09-7 Molecular Formula: C20H30O2 Molecular Weight (g/mol): 302.46 MDL Number: MFCD00132205 InChI Key: RSWGJHLUYNHPMX-UHFFFAOYNA-N Synonym: 4bs,1r,10ar,4ar-1,4a-dimethyl-7-methylethyl-1,2,3,4,5,6,10,10a,4a,4b-decah ydrophenanthrenecarboxylic acid,4ar-7-isopropyl-1,4a-dimethyl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid
4-Bromo-1-trityl-1H-pyrazole, 95%
CAS: 95162-14-4 Molecular Formula: C22H17BrN2 Molecular Weight (g/mol): 389.30 MDL Number: MFCD09907863 InChI Key: CPENTLJGGGSVAJ-UHFFFAOYSA-N Synonym: 4-bromo-1-trityl-1h-pyrazole,1h-pyrazole, 4-bromo-1-triphenylmethyl,1h-pyrazole,4-bromo-1-triphenylmethyl,4-bromo-1-triphenylmethyl-1h-pyrazole,4-bromo-1-triphenylmethyl pyrazole,n-trityl-4-bromopyrazole,4-bromo-1-n-tritylpyrazole,1-trityl-4-bromo-1h-pyrazole,4-bromo-1-trityl-1-h-pyrazole PubChem CID: 10834188 IUPAC Name: 4-bromo-1-(triphenylmethyl)-1H-pyrazole SMILES: BrC1=CN(N=C1)C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
4-Bromo-2,6-difluorophenylacetic acid, 96%, Thermo Scientific™
CAS: 537033-54-8 Molecular Formula: C8H5BrF2O2 Molecular Weight (g/mol): 251.03 MDL Number: MFCD03094466 InChI Key: GBFFYYLXGIHKLU-UHFFFAOYSA-N Synonym: 4-bromo-2,6-difluorophenylacetic acid,2-4-bromo-2,6-difluorophenyl acetic acid,4-bromo-2,6-difluorophenyl acetic acid,2-4-bromo-2,6-difluoro-phenyl acetic acid,acmc-209uz8,4-bromo-2,6-difluorophenylaceticacid,4-bromo-2,6-difluorobenzeneacetic acid,4-bromo-2,6-difluoro-phenyl-acetic acid,benzeneacetic acid, 4-bromo-2,6-difluoro PubChem CID: 2773309 IUPAC Name: 2-(4-bromo-2,6-difluorophenyl)acetic acid SMILES: OC(=O)CC1=C(F)C=C(Br)C=C1F
4-(Fmoc-aminomethyl)benzoic acid, 95%
CAS: 164470-64-8 Molecular Formula: C23H19NO4 Molecular Weight (g/mol): 373.41 MDL Number: MFCD01074693 InChI Key: JRHUROPSUJVMNH-UHFFFAOYSA-N Synonym: fmoc-4-amb-oh,4-9h-fluoren-9-yl methoxy carbonyl amino methyl benzoic acid,4-9h-fluoren-9-ylmethoxycarbonylamino methyl benzoic acid,4-9h-fluoren-9-ylmethoxy carbonyl amino methyl benzoic acid,4-n-fmoc-aminomethyl-benzoic acid,4-fmoc-aminomethyl benzoicacid,4-fmoc-aminomethyl benzoic acid,fmoc-4-amb-oh fmoc-4-aminomethyl benzoic acid PubChem CID: 2756083 IUPAC Name: 4-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]benzoic acid SMILES: OC(=O)C1=CC=C(CNC(=O)OCC2C3=CC=CC=C3C3=CC=CC=C23)C=C1
Methyl 4-aminosalicylate, 97%, Thermo Scientific Chemicals
CAS: 4136-97-4 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.164 MDL Number: MFCD00088091 InChI Key: QQOXBFUTRLDXDP-UHFFFAOYSA-N Synonym: methyl 4-aminosalicylate,methyl p-aminosalicylate,pas methyl ester,p-aminosalicylic acid methyl ester,methyl 4-amino-2-hydroxybenzenecarboxylate,benzoic acid, 4-amino-2-hydroxy-, methyl ester,methyl 4-amino-2-hydroxy-benzoate,salicylic acid, amino-, methyl ester,4-aminosalicylic acid methyl ester,4-amino-2-hydroxy-benzoic acid methyl ester PubChem CID: 77787 ChEBI: CHEBI:35089 IUPAC Name: methyl 4-amino-2-hydroxybenzoate SMILES: COC(=O)C1=C(C=C(C=C1)N)O
3-Carboxy-5-fluorobenzeneboronic acid pinacol ester, 96%, Thermo Scientific Chemicals
CAS: 936728-22-2 Molecular Formula: C13H16BFO4 Molecular Weight (g/mol): 266.075 MDL Number: MFCD12756465 InChI Key: NMYIHYHALOHVHV-UHFFFAOYSA-N Synonym: 3-fluoro-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzoic acid,3-carboxy-5-fluorophenylboronic acid, pinacol ester,3-carboxy-5-fluorobenzeneboronic acid pinacol ester,3-fluoro-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzoicacid,3-fluoro-5-tetramethyl-1,3,2-dioxaborolan-2-yl benzoic acid PubChem CID: 46739807 IUPAC Name: 3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2)F)C(=O)O
3-Aminosalicylic acid, MP Biomedicals™
CAS: 570-23-0 Molecular Formula: C7H7NO3 Molecular Weight (g/mol): 153.137 InChI Key: IQGMRVWUTCYCST-UHFFFAOYSA-N Synonym: 3-aminosalicylic acid,3-amino salicylic acid,benzoic acid, 3-amino-2-hydroxy,3-amino-2-hydroxy-benzoic acid,2-amino-6-carboxyphenol,salicylic acid, 3-amino,3-carboxy-2-hydroxyaniline,3 or 5-aminosalicylic acid,benzoic acid, amino-2-hydroxy PubChem CID: 68443 IUPAC Name: 3-amino-2-hydroxybenzoic acid SMILES: C1=CC(=C(C(=C1)N)O)C(=O)O
1-Benzhydryl-3-azetidinol, 97%
CAS: 18621-17-5 Molecular Formula: C16H17NO Molecular Weight (g/mol): 239.32 MDL Number: MFCD00205109 InChI Key: MMAJXKGUZYDTHV-UHFFFAOYSA-N Synonym: 1-benzhydrylazetan-3-ol,1-diphenylmethyl-3-hydroxyazetidine,1-diphenylmethyl azetidin-3-ol,1-benzhydryl-3-azetidinol,1-benzhydryl-3-hydroxyazetidine,1-benzhydryl-azetidin-3-ol,n-benzhydrylazetidin-3-ol,3-azetidinol, 1-diphenylmethyl,1-diphenylmethyl-3-azetidinol PubChem CID: 330448 IUPAC Name: 1-(diphenylmethyl)azetidin-3-ol SMILES: OC1CN(C1)C(C1=CC=CC=C1)C1=CC=CC=C1
Methyl 4-hydroxy-3-nitrobenzoate, 98+%
CAS: 99-42-3 Molecular Formula: C8H7NO5 Molecular Weight (g/mol): 197.146 MDL Number: MFCD00014695 InChI Key: GNCWCTBHZCBXGL-UHFFFAOYSA-N Synonym: methyl 3-nitro-4-hydroxybenzoate,benzoic acid, 4-hydroxy-3-nitro-, methyl ester,4-hydroxy-3-nitrobenzoic acid methyl ester,methyl 3-nitro-4-hydroxy toluate,aurora 6897,3-nitro-4-hydroxybenzoic acid methyl ester,methyl-4-hydroxy-3-nitrobenzoic acid,3-nitro-4-hydroxymethylbenzoate,acmc-209scn,3-10-00-00378 beilstein handbook reference PubChem CID: 66835 IUPAC Name: methyl 4-hydroxy-3-nitrobenzoate SMILES: COC(=O)C1=CC(=C(C=C1)O)[N+](=O)[O-]
Octafluorotoluene, 98+%
CAS: 434-64-0 Molecular Formula: C7F8 Molecular Weight (g/mol): 236.06 MDL Number: MFCD00000375 InChI Key: USPWUOFNOTUBAD-UHFFFAOYSA-N Synonym: octafluorotoluene,perfluorotoluene,1,2,3,4,5-pentafluoro-6-trifluoromethyl benzene,toluene, octafluoro,benzene, pentafluoro trifluoromethyl,trifluoromethyl pentafluorobenzene,pentafluorobenzotrifluoride,1,2,3,4,5-pentafluoro-6-trifluoromethyl-benzene,benzene, 1,2,3,4,5-pentafluoro-6-trifluoromethyl,acmc-209juh PubChem CID: 9906 IUPAC Name: 1,2,3,4,5-pentafluoro-6-(trifluoromethyl)benzene SMILES: FC1=C(F)C(F)=C(C(F)=C1F)C(F)(F)F
m-Xylylene dichloride, 97%
CAS: 626-16-4 Molecular Formula: C8H8Cl2 Molecular Weight (g/mol): 175.052 MDL Number: MFCD00000912 InChI Key: GRJWOKACBGZOKT-UHFFFAOYSA-N Synonym: 1,3-bis chloromethyl benzene,alpha,alpha'-dichloro-m-xylene,m-xylylene dichloride,benzene, 1,3-bis chloromethyl,m-bis chloromethyl benzene,m-xylylene chloride,m-dichloroxylene,benzene, 1,3-dichloromethyl,ccris 1774,m-xylene, .alpha.,.alpha.'-dichloro PubChem CID: 12275 IUPAC Name: 1,3-bis(chloromethyl)benzene SMILES: C1=CC(=CC(=C1)CCl)CCl
3,5-Difluoro-4-hydroxybenzeneboronic acid pinacol ester, 96%, Thermo Scientific Chemicals
CAS: 1029439-83-5 Molecular Formula: C12H15BF2O3 Molecular Weight (g/mol): 256.056 MDL Number: MFCD16996286 InChI Key: KTQYJNVSVKKLGQ-UHFFFAOYSA-N Synonym: 2,6-difluoro-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenol,3,5-difluoro-4-hydroxybenzeneboronic acid pinacol ester,3,5-difluoro-4-hydroxyphenylboronic acid pinacol ester PubChem CID: 57655406 IUPAC Name: 2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(C(=C2)F)O)F
Phenylazoformic acid 2-phenylhydrazide
CAS: 538-62-5 Molecular Formula: C13H12N4O Molecular Weight (g/mol): 240.266 MDL Number: MFCD00003024 InChI Key: ZFWAHZCOKGWUIT-UHFFFAOYSA-N Synonym: 1,5-diphenylcarbazone,diazenecarboxylic acid, phenyl-, 2-phenylhydrazide,unii-5uyj4r0d5t,phenylazoformic acid 2-phenylhydrazide,sym-diphenylcarbazone,5uyj4r0d5t,chembl79409,3-hydroxy-1,5-diphenylformazan,phenyldiazenecarboxylic acid 2-phenylhydrazide,3-phenylamino-1-phenylimino urea PubChem CID: 10860 IUPAC Name: 1-anilino-3-phenyliminourea SMILES: C1=CC=C(C=C1)NNC(=O)N=NC2=CC=CC=C2
3-Chlorostyrene, 98%, stab. with 0.1% 4-tert-butylcatechol
CAS: 2039-85-2 Molecular Formula: C8H7Cl Molecular Weight (g/mol): 138.594 MDL Number: MFCD00000598 InChI Key: BOVQCIDBZXNFEJ-UHFFFAOYSA-N Synonym: 3-chlorostyrene,1-chloro-3-vinylbenzene,m-chlorostyrene,benzene, 1-chloro-3-ethenyl,styrene, m-chloro,unii-11k8g759hc,1-chloro-3-vinyl-benzene,styrene, 3-chloro,meta-chlorostyrene,zlchem 318 PubChem CID: 14905 IUPAC Name: 1-chloro-3-ethenylbenzene SMILES: C=CC1=CC(=CC=C1)Cl
4-Chloro-3-sulfamoylbenzoic acid, 98%
CAS: 1205-30-7 Molecular Formula: C7H6ClNO4S Molecular Weight (g/mol): 235.638 MDL Number: MFCD00012375 InChI Key: FHQAWINGVCDTTG-UHFFFAOYSA-N Synonym: 4-chloro-5-sulphamoylbenzoic acid,3-aminosulfonyl-4-chlorobenzoic acid,csba,sulfamido-3-chlorobenzoic acid,benzoic acid, 3-aminosulfonyl-4-chloro,3-sulfamoyl-4-chlorobenzoic acid,benzoic acid, 4-chloro-3-sulfamoyl,4-chloro-3-sulfamoyl-benzoic acid,4-chloro-5-sulfamoylbenzoic acid,4-chloro-3-sulphamoylbenzoic acid PubChem CID: 14568 IUPAC Name: 4-chloro-3-sulfamoylbenzoic acid SMILES: C1=CC(=C(C=C1C(=O)O)S(=O)(=O)N)Cl