Benzene and substituted derivatives
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Mordant Blue 29, TCI America™
CAS: 1667-99-8 Molecular Formula: C23H13Cl2Na3O9S Molecular Weight (g/mol): 605.277 MDL Number: MFCD00001615 InChI Key: FUIZKNBTOOKONL-UHFFFAOYSA-K Synonym: mordant blue 29,chromeazurol s,chrome azurol s,trisodium 5-3-carboxylato-5-methyl-4-oxo-cyclohexa-2,5-dien-1-ylidene-2,6-dichloro-3-sulfonato-phenyl methyl-2-hydroxy-3-methyl-benzoate,trisodium 5-3-carboxylato-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene-2,6-dichloro-3-sulfonatophenyl methyl-2-hydroxy-3-methylbenzoate PubChem CID: 54736314 IUPAC Name: trisodium;5-[(3-carboxy-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)-(2,6-dichloro-3-sulfonatophenyl)methyl]-3-methyl-2-oxidobenzoate SMILES: CC1=CC(=CC(=C1[O-])C(=O)[O-])C(=C2C=C(C(=O)C(=C2)C(=O)O)C)C3=C(C=CC(=C3Cl)S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+]
| PubChem CID | 54736314 |
|---|---|
| CAS | 1667-99-8 |
| Molecular Weight (g/mol) | 605.277 |
| MDL Number | MFCD00001615 |
| SMILES | CC1=CC(=CC(=C1[O-])C(=O)[O-])C(=C2C=C(C(=O)C(=C2)C(=O)O)C)C3=C(C=CC(=C3Cl)S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+] |
| Synonym | mordant blue 29,chromeazurol s,chrome azurol s,trisodium 5-3-carboxylato-5-methyl-4-oxo-cyclohexa-2,5-dien-1-ylidene-2,6-dichloro-3-sulfonato-phenyl methyl-2-hydroxy-3-methyl-benzoate,trisodium 5-3-carboxylato-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene-2,6-dichloro-3-sulfonatophenyl methyl-2-hydroxy-3-methylbenzoate |
| IUPAC Name | trisodium;5-[(3-carboxy-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)-(2,6-dichloro-3-sulfonatophenyl)methyl]-3-methyl-2-oxidobenzoate |
| InChI Key | FUIZKNBTOOKONL-UHFFFAOYSA-K |
| Molecular Formula | C23H13Cl2Na3O9S |
Benzhydrylamine Hydrochloride 98.0+%, TCI America™
CAS: 5267-34-5 Molecular Formula: C13H14ClN Molecular Weight (g/mol): 219.712 MDL Number: MFCD00013023 InChI Key: CIHWJRSPVJBHGT-UHFFFAOYSA-N Synonym: benzhydrylamine hydrochloride,aminodiphenylmethane hydrochloride,benzhydrylamine, hydrochloride,diphenylmethanamine hydrochloride,benzhydrylammonium chloride,aminodiphenylmethane hcl,1,1-diphenylmethylamine hydrochloride,diphenylmethylamine, chloride,benzhydrylamin hydrochloride,bha-polystyrene PubChem CID: 78921 IUPAC Name: diphenylmethanamine;hydrochloride SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)N.Cl
| PubChem CID | 78921 |
|---|---|
| CAS | 5267-34-5 |
| Molecular Weight (g/mol) | 219.712 |
| MDL Number | MFCD00013023 |
| SMILES | C1=CC=C(C=C1)C(C2=CC=CC=C2)N.Cl |
| Synonym | benzhydrylamine hydrochloride,aminodiphenylmethane hydrochloride,benzhydrylamine, hydrochloride,diphenylmethanamine hydrochloride,benzhydrylammonium chloride,aminodiphenylmethane hcl,1,1-diphenylmethylamine hydrochloride,diphenylmethylamine, chloride,benzhydrylamin hydrochloride,bha-polystyrene |
| IUPAC Name | diphenylmethanamine;hydrochloride |
| InChI Key | CIHWJRSPVJBHGT-UHFFFAOYSA-N |
| Molecular Formula | C13H14ClN |
2,2-Bis[4-(4-maleimidophenoxy)phenyl]propane 98.0+%, TCI America™
CAS: 79922-55-7 Molecular Formula: C35H26N2O6 Molecular Weight (g/mol): 570.601 InChI Key: XAZPKEBWNIUCKF-UHFFFAOYSA-N Synonym: Bisphenol A Bis(4-maleimidophenyl Ether) PubChem CID: 3086113 IUPAC Name: 1-[4-[4-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]pyrrole-2,5-dione SMILES: CC(C)(C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)C=CC3=O)C4=CC=C(C=C4)OC5=CC=C(C=C5)N6C(=O)C=CC6=O
| PubChem CID | 3086113 |
|---|---|
| CAS | 79922-55-7 |
| Molecular Weight (g/mol) | 570.601 |
| SMILES | CC(C)(C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)C=CC3=O)C4=CC=C(C=C4)OC5=CC=C(C=C5)N6C(=O)C=CC6=O |
| Synonym | Bisphenol A Bis(4-maleimidophenyl Ether) |
| IUPAC Name | 1-[4-[4-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]pyrrole-2,5-dione |
| InChI Key | XAZPKEBWNIUCKF-UHFFFAOYSA-N |
| Molecular Formula | C35H26N2O6 |
N-Methoxy-N-methylbenzamide 98.0+%, TCI America™
CAS: 6919-61-5 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.192 MDL Number: MFCD00075320 InChI Key: UKERDACREYXSIV-UHFFFAOYSA-N Synonym: n-methyl-n-methoxybenzamide,benzamide, n-methoxy-n-methyl,n-methoxy-n-methyl-benzamide,methyl n-methylbenzohydroxamate,pubchem17496,acmc-1b5bp,n-methoxy-n-methylbenzamid,n-methoxy-n-methyl benzamide,ksc445c3n,n-methoxy-n-methylbenzamide PubChem CID: 569575 ChEBI: CHEBI:59742 IUPAC Name: N-methoxy-N-methylbenzamide SMILES: CN(C(=O)C1=CC=CC=C1)OC
| PubChem CID | 569575 |
|---|---|
| CAS | 6919-61-5 |
| Molecular Weight (g/mol) | 165.192 |
| ChEBI | CHEBI:59742 |
| MDL Number | MFCD00075320 |
| SMILES | CN(C(=O)C1=CC=CC=C1)OC |
| Synonym | n-methyl-n-methoxybenzamide,benzamide, n-methoxy-n-methyl,n-methoxy-n-methyl-benzamide,methyl n-methylbenzohydroxamate,pubchem17496,acmc-1b5bp,n-methoxy-n-methylbenzamid,n-methoxy-n-methyl benzamide,ksc445c3n,n-methoxy-n-methylbenzamide |
| IUPAC Name | N-methoxy-N-methylbenzamide |
| InChI Key | UKERDACREYXSIV-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO2 |
Bisacodyl 98.0+%, TCI America™
CAS: 603-50-9 Molecular Formula: C22H19NO4 Molecular Weight (g/mol): 361.40 MDL Number: MFCD00038039 InChI Key: KHOITXIGCFIULA-UHFFFAOYSA-N Synonym: bisacodyl,dulcolax,bicol,brocalax,durolax,dulcolan,endokolat,fenilaxan,hillcolax,sanvacual PubChem CID: 2391 IUPAC Name: 4-{[4-(acetyloxy)phenyl](pyridin-2-yl)methyl}phenyl acetate SMILES: CC(=O)OC1=CC=C(C=C1)C(C1=CC=C(OC(C)=O)C=C1)C1=CC=CC=N1
| PubChem CID | 2391 |
|---|---|
| CAS | 603-50-9 |
| Molecular Weight (g/mol) | 361.40 |
| MDL Number | MFCD00038039 |
| SMILES | CC(=O)OC1=CC=C(C=C1)C(C1=CC=C(OC(C)=O)C=C1)C1=CC=CC=N1 |
| Synonym | bisacodyl,dulcolax,bicol,brocalax,durolax,dulcolan,endokolat,fenilaxan,hillcolax,sanvacual |
| IUPAC Name | 4-{[4-(acetyloxy)phenyl](pyridin-2-yl)methyl}phenyl acetate |
| InChI Key | KHOITXIGCFIULA-UHFFFAOYSA-N |
| Molecular Formula | C22H19NO4 |
4,4'-Isopropylidenediphenol Dimethacrylate 98.0+%, TCI America™
CAS: 3253-39-2 Molecular Formula: C23H24O4 Molecular Weight (g/mol): 364.44 MDL Number: MFCD00008585 InChI Key: QUZSUMLPWDHKCJ-UHFFFAOYSA-N Synonym: bisphenol a dimethacrylate,2,2-di 4-methacryloxyphenyl propane,4,4'-isopropylidenediphenol dimethacrylate,4,4'-isopropylidenediphenyl dimethacrylate,2-propenoic acid, 2-methyl-, 1-methylethylidene di-4,1-phenylene ester,propane-2,2-diylbis 4,1-phenylene bis 2-methylacrylate,4-2-4-2-methylprop-2-enoyloxy phenyl propan-2-yl phenyl 2-methylprop-2-enoate,bis-dma,2-propenoic acid, 2-methyl-, 1,1'-1-methylethylidene di-4,1-phenylene ester PubChem CID: 76739 ChEBI: CHEBI:34579 IUPAC Name: 4-(2-{4-[(2-methylprop-2-enoyl)oxy]phenyl}propan-2-yl)phenyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OC1=CC=C(C=C1)C(C)(C)C1=CC=C(OC(=O)C(C)=C)C=C1
| PubChem CID | 76739 |
|---|---|
| CAS | 3253-39-2 |
| Molecular Weight (g/mol) | 364.44 |
| ChEBI | CHEBI:34579 |
| MDL Number | MFCD00008585 |
| SMILES | CC(=C)C(=O)OC1=CC=C(C=C1)C(C)(C)C1=CC=C(OC(=O)C(C)=C)C=C1 |
| Synonym | bisphenol a dimethacrylate,2,2-di 4-methacryloxyphenyl propane,4,4'-isopropylidenediphenol dimethacrylate,4,4'-isopropylidenediphenyl dimethacrylate,2-propenoic acid, 2-methyl-, 1-methylethylidene di-4,1-phenylene ester,propane-2,2-diylbis 4,1-phenylene bis 2-methylacrylate,4-2-4-2-methylprop-2-enoyloxy phenyl propan-2-yl phenyl 2-methylprop-2-enoate,bis-dma,2-propenoic acid, 2-methyl-, 1,1'-1-methylethylidene di-4,1-phenylene ester |
| IUPAC Name | 4-(2-{4-[(2-methylprop-2-enoyl)oxy]phenyl}propan-2-yl)phenyl 2-methylprop-2-enoate |
| InChI Key | QUZSUMLPWDHKCJ-UHFFFAOYSA-N |
| Molecular Formula | C23H24O4 |
Cyclopropyldiphenylcarbinol 98.0+%, TCI America™
CAS: 5785-66-0 Molecular Formula: C16H16O Molecular Weight (g/mol): 224.30 MDL Number: MFCD00001298 InChI Key: MFKPHBJFWOOEDT-UHFFFAOYSA-N Synonym: cyclopropyldiphenylcarbinol,cyclopropyl diphenyl carbinol,methanol, cyclopropyldiphenyl,alpha-cyclopropylbenzhydrylic alcohol,cyclopropyl diphenyl methanol,diphenyl cyclopropyl carbinol,alpha-cyclopropyl-alpha-phenylbenzyl alcohol,benzyl alcohol, alpha-cyclopropyl-alpha-phenyl,benzenemethanol, alpha-cyclopropyl-alpha-phenyl-9ci,benzenemethanol, alpha-cyclopropyl-alpha-phenyl PubChem CID: 79850 IUPAC Name: cyclopropyldiphenylmethanol SMILES: OC(C1CC1)(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 79850 |
|---|---|
| CAS | 5785-66-0 |
| Molecular Weight (g/mol) | 224.30 |
| MDL Number | MFCD00001298 |
| SMILES | OC(C1CC1)(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | cyclopropyldiphenylcarbinol,cyclopropyl diphenyl carbinol,methanol, cyclopropyldiphenyl,alpha-cyclopropylbenzhydrylic alcohol,cyclopropyl diphenyl methanol,diphenyl cyclopropyl carbinol,alpha-cyclopropyl-alpha-phenylbenzyl alcohol,benzyl alcohol, alpha-cyclopropyl-alpha-phenyl,benzenemethanol, alpha-cyclopropyl-alpha-phenyl-9ci,benzenemethanol, alpha-cyclopropyl-alpha-phenyl |
| IUPAC Name | cyclopropyldiphenylmethanol |
| InChI Key | MFKPHBJFWOOEDT-UHFFFAOYSA-N |
| Molecular Formula | C16H16O |
1,1-Diphenylethylene (stabilized with HQ) 98.0+%, TCI America™
CAS: 530-48-3 Molecular Formula: C14H12 Molecular Weight (g/mol): 180.25 MDL Number: MFCD00008583 InChI Key: ZMYIIHDQURVDRB-UHFFFAOYSA-N Synonym: 1,1-diphenylethylene,ethene-1,1-diyldibenzene,1,1-diphenylethene,benzene, 1,1'-ethenylidenebis,1-phenylethenyl benzene,unii-bx0l5b6lll,as-diphenylethylene,.alpha.-phenylstyrene,1-phenylvinyl benzene,bx0l5b6lll PubChem CID: 10740 IUPAC Name: 1-phenylethenylbenzene SMILES: C=C(C1=CC=CC=C1)C2=CC=CC=C2
| PubChem CID | 10740 |
|---|---|
| CAS | 530-48-3 |
| Molecular Weight (g/mol) | 180.25 |
| MDL Number | MFCD00008583 |
| SMILES | C=C(C1=CC=CC=C1)C2=CC=CC=C2 |
| Synonym | 1,1-diphenylethylene,ethene-1,1-diyldibenzene,1,1-diphenylethene,benzene, 1,1'-ethenylidenebis,1-phenylethenyl benzene,unii-bx0l5b6lll,as-diphenylethylene,.alpha.-phenylstyrene,1-phenylvinyl benzene,bx0l5b6lll |
| IUPAC Name | 1-phenylethenylbenzene |
| InChI Key | ZMYIIHDQURVDRB-UHFFFAOYSA-N |
| Molecular Formula | C14H12 |
1,1-Diphenylacetone 99.0+%, TCI America™
CAS: 781-35-1 Molecular Formula: C15H14O Molecular Weight (g/mol): 210.276 MDL Number: MFCD00008759 InChI Key: DBNWBEGCONIRGQ-UHFFFAOYSA-N Synonym: 1,1-diphenylacetone,1,1-diphenyl-2-propanone,2-propanone, 1,1-diphenyl,1,1-diphenyl acetone,methyl diphenylmethyl ketone,ketone, diphenylmethyl methyl,benzhydryl methyl ketone,diphenylacetone,3,3-diphenyl acetone,2-propanone, diphenyl PubChem CID: 69907 IUPAC Name: 1,1-diphenylpropan-2-one SMILES: CC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2
| PubChem CID | 69907 |
|---|---|
| CAS | 781-35-1 |
| Molecular Weight (g/mol) | 210.276 |
| MDL Number | MFCD00008759 |
| SMILES | CC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2 |
| Synonym | 1,1-diphenylacetone,1,1-diphenyl-2-propanone,2-propanone, 1,1-diphenyl,1,1-diphenyl acetone,methyl diphenylmethyl ketone,ketone, diphenylmethyl methyl,benzhydryl methyl ketone,diphenylacetone,3,3-diphenyl acetone,2-propanone, diphenyl |
| IUPAC Name | 1,1-diphenylpropan-2-one |
| InChI Key | DBNWBEGCONIRGQ-UHFFFAOYSA-N |
| Molecular Formula | C15H14O |
4,4'-Methylenebis(benzenesulfonyl Chloride) 95.0+%, TCI America™
CAS: 3119-64-0 Molecular Formula: C13H10Cl2O4S2 Molecular Weight (g/mol): 365.24 MDL Number: MFCD00012363 InChI Key: YKMMQCFZCFAHOU-UHFFFAOYSA-N Synonym: Bis(4-chlorosulfonylphenyl)methane PubChem CID: 3368486 IUPAC Name: 4-{[4-(chlorosulfonyl)phenyl]methyl}benzene-1-sulfonyl chloride SMILES: ClS(=O)(=O)C1=CC=C(CC2=CC=C(C=C2)S(Cl)(=O)=O)C=C1
| PubChem CID | 3368486 |
|---|---|
| CAS | 3119-64-0 |
| Molecular Weight (g/mol) | 365.24 |
| MDL Number | MFCD00012363 |
| SMILES | ClS(=O)(=O)C1=CC=C(CC2=CC=C(C=C2)S(Cl)(=O)=O)C=C1 |
| Synonym | Bis(4-chlorosulfonylphenyl)methane |
| IUPAC Name | 4-{[4-(chlorosulfonyl)phenyl]methyl}benzene-1-sulfonyl chloride |
| InChI Key | YKMMQCFZCFAHOU-UHFFFAOYSA-N |
| Molecular Formula | C13H10Cl2O4S2 |
2,2'-Methylenebis(6-tert-butyl-4-ethylphenol) 98.0+%, TCI America™
CAS: 88-24-4 Molecular Formula: C25H36O2 Molecular Weight (g/mol): 368.561 MDL Number: MFCD00026296 InChI Key: GPNYZBKIGXGYNU-UHFFFAOYSA-N PubChem CID: 6928 IUPAC Name: 2-tert-butyl-6-[(3-tert-butyl-5-ethyl-2-hydroxyphenyl)methyl]-4-ethylphenol SMILES: CCC1=CC(=C(C(=C1)C(C)(C)C)O)CC2=C(C(=CC(=C2)CC)C(C)(C)C)O
| PubChem CID | 6928 |
|---|---|
| CAS | 88-24-4 |
| Molecular Weight (g/mol) | 368.561 |
| MDL Number | MFCD00026296 |
| SMILES | CCC1=CC(=C(C(=C1)C(C)(C)C)O)CC2=C(C(=CC(=C2)CC)C(C)(C)C)O |
| IUPAC Name | 2-tert-butyl-6-[(3-tert-butyl-5-ethyl-2-hydroxyphenyl)methyl]-4-ethylphenol |
| InChI Key | GPNYZBKIGXGYNU-UHFFFAOYSA-N |
| Molecular Formula | C25H36O2 |
Bis(3-ethyl-5-methyl-4-maleimidophenyl)methane 98.0+%, TCI America™
CAS: 105391-33-1 Molecular Formula: C27H26N2O4 Molecular Weight (g/mol): 442.515 MDL Number: MFCD00467754 InChI Key: YNSSPVZNXLACMW-UHFFFAOYSA-N Synonym: Methylenebis(3-ethyl-5-methyl-4-maleimidobenzene) PubChem CID: 10950302 IUPAC Name: 1-[4-[[4-(2,5-dioxopyrrol-1-yl)-3-ethyl-5-methylphenyl]methyl]-2-ethyl-6-methylphenyl]pyrrole-2,5-dione SMILES: CCC1=CC(=CC(=C1N2C(=O)C=CC2=O)C)CC3=CC(=C(C(=C3)CC)N4C(=O)C=CC4=O)C
| PubChem CID | 10950302 |
|---|---|
| CAS | 105391-33-1 |
| Molecular Weight (g/mol) | 442.515 |
| MDL Number | MFCD00467754 |
| SMILES | CCC1=CC(=CC(=C1N2C(=O)C=CC2=O)C)CC3=CC(=C(C(=C3)CC)N4C(=O)C=CC4=O)C |
| Synonym | Methylenebis(3-ethyl-5-methyl-4-maleimidobenzene) |
| IUPAC Name | 1-[4-[[4-(2,5-dioxopyrrol-1-yl)-3-ethyl-5-methylphenyl]methyl]-2-ethyl-6-methylphenyl]pyrrole-2,5-dione |
| InChI Key | YNSSPVZNXLACMW-UHFFFAOYSA-N |
| Molecular Formula | C27H26N2O4 |
4,4'-Dinitrodiphenylmethane 99.0+%, TCI America™
CAS: 1817-74-9 Molecular Formula: C13H10N2O4 Molecular Weight (g/mol): 258.23 MDL Number: MFCD00059184 InChI Key: GLBZQZXDUTUCGK-UHFFFAOYSA-N PubChem CID: 15753 IUPAC Name: 1-nitro-4-[(4-nitrophenyl)methyl]benzene SMILES: [O-][N+](=O)C1=CC=C(CC2=CC=C(C=C2)[N+]([O-])=O)C=C1
| PubChem CID | 15753 |
|---|---|
| CAS | 1817-74-9 |
| Molecular Weight (g/mol) | 258.23 |
| MDL Number | MFCD00059184 |
| SMILES | [O-][N+](=O)C1=CC=C(CC2=CC=C(C=C2)[N+]([O-])=O)C=C1 |
| IUPAC Name | 1-nitro-4-[(4-nitrophenyl)methyl]benzene |
| InChI Key | GLBZQZXDUTUCGK-UHFFFAOYSA-N |
| Molecular Formula | C13H10N2O4 |
1,1-Diphenyl-2-propyn-1-ol 97.0+%, TCI America™
CAS: 3923-52-2 Molecular Formula: C15H12O Molecular Weight (g/mol): 208.26 MDL Number: MFCD00041570 InChI Key: SMCLTAARQYTXLW-UHFFFAOYSA-N Synonym: 1,1-diphenyl-2-propyn-1-ol,diphenylethinylcarbinol,ethynyldiphenylmethanol,1,1-diphenylpropargyl alcohol,diphenylethynylcarbinol,3,3-diphenyl-3-hydroxy-1-propyne,benzenemethanol, .alpha.-ethynyl-.alpha.-phenyl,2-propyn-1-ol, 1,1-diphenyl,benzenemethanol, alpha-ethynyl-alpha-phenyl,benzenemethanol, a-ethynyl-a-phenyl PubChem CID: 92976 IUPAC Name: 1,1-diphenylprop-2-yn-1-ol SMILES: OC(C#C)(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 92976 |
|---|---|
| CAS | 3923-52-2 |
| Molecular Weight (g/mol) | 208.26 |
| MDL Number | MFCD00041570 |
| SMILES | OC(C#C)(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | 1,1-diphenyl-2-propyn-1-ol,diphenylethinylcarbinol,ethynyldiphenylmethanol,1,1-diphenylpropargyl alcohol,diphenylethynylcarbinol,3,3-diphenyl-3-hydroxy-1-propyne,benzenemethanol, .alpha.-ethynyl-.alpha.-phenyl,2-propyn-1-ol, 1,1-diphenyl,benzenemethanol, alpha-ethynyl-alpha-phenyl,benzenemethanol, a-ethynyl-a-phenyl |
| IUPAC Name | 1,1-diphenylprop-2-yn-1-ol |
| InChI Key | SMCLTAARQYTXLW-UHFFFAOYSA-N |
| Molecular Formula | C15H12O |
Benzoyl Cyanide 98.0+%, TCI America™
CAS: 613-90-1 Molecular Formula: C8H5NO Molecular Weight (g/mol): 131.134 MDL Number: MFCD00001837 InChI Key: GJQBHOAJJGIPRH-UHFFFAOYSA-N Synonym: phenylglyoxylonitrile,benzoyl nitrile,benzoylcyanide,oxo phenyl acetonitrile,alpha-oxobenzeneacetonitrile,benzeneacetonitrile, .alpha.-oxo,glyoxylonitrile, phenyl,alpha-oxo-alpha-tolunitrile,2-oxo-2-phenylethanenitrile,alpha-tolunitrile, alpha-oxo PubChem CID: 11953 ChEBI: CHEBI:51853 IUPAC Name: benzoyl cyanide SMILES: C1=CC=C(C=C1)C(=O)C#N
| PubChem CID | 11953 |
|---|---|
| CAS | 613-90-1 |
| Molecular Weight (g/mol) | 131.134 |
| ChEBI | CHEBI:51853 |
| MDL Number | MFCD00001837 |
| SMILES | C1=CC=C(C=C1)C(=O)C#N |
| Synonym | phenylglyoxylonitrile,benzoyl nitrile,benzoylcyanide,oxo phenyl acetonitrile,alpha-oxobenzeneacetonitrile,benzeneacetonitrile, .alpha.-oxo,glyoxylonitrile, phenyl,alpha-oxo-alpha-tolunitrile,2-oxo-2-phenylethanenitrile,alpha-tolunitrile, alpha-oxo |
| IUPAC Name | benzoyl cyanide |
| InChI Key | GJQBHOAJJGIPRH-UHFFFAOYSA-N |
| Molecular Formula | C8H5NO |