Benzene and substituted derivatives
Filtered Search Results
4-Bromo-2-chloroaniline, 99%
CAS: 38762-41-3 Molecular Formula: C6H5BrClN Molecular Weight (g/mol): 206.47 MDL Number: MFCD00007660 InChI Key: INMZDDDQLHKGPF-UHFFFAOYSA-N Synonym: 2-chloro-4-bromoaniline,4-bromo-2-chloro-phenylamine,benzenamine, 4-bromo-2-chloro,4-bromo-2-chloro-aniline,4-bromo-2-chlorophenylamine,4-bromo-6-chloroaniline,4-bromo-2-chlorobenzenamine,zlchem 546,pubchem3578,2-chloro4-bromoaniline PubChem CID: 610169 IUPAC Name: 4-bromo-2-chloroaniline SMILES: C1=CC(=C(C=C1Br)Cl)N
| PubChem CID | 610169 |
|---|---|
| CAS | 38762-41-3 |
| Molecular Weight (g/mol) | 206.47 |
| MDL Number | MFCD00007660 |
| SMILES | C1=CC(=C(C=C1Br)Cl)N |
| Synonym | 2-chloro-4-bromoaniline,4-bromo-2-chloro-phenylamine,benzenamine, 4-bromo-2-chloro,4-bromo-2-chloro-aniline,4-bromo-2-chlorophenylamine,4-bromo-6-chloroaniline,4-bromo-2-chlorobenzenamine,zlchem 546,pubchem3578,2-chloro4-bromoaniline |
| IUPAC Name | 4-bromo-2-chloroaniline |
| InChI Key | INMZDDDQLHKGPF-UHFFFAOYSA-N |
| Molecular Formula | C6H5BrClN |
2-Chlorobenzoic acid, 98+%
CAS: 118-91-2 Molecular Formula: C7H5ClO2 Molecular Weight (g/mol): 156.565 MDL Number: MFCD00002412 InChI Key: IKCLCGXPQILATA-UHFFFAOYSA-N Synonym: o-chlorobenzoic acid,benzoic acid, o-chloro,benzoic acid, 2-chloro,2-cba,kyselina o-chlorbenzoova,chlorobenzoic acid,ocba,benzoic acid, chloro,2-chloro-benzoic acid,chlorobenzoate PubChem CID: 8374 ChEBI: CHEBI:30793 IUPAC Name: 2-chlorobenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)Cl
| PubChem CID | 8374 |
|---|---|
| CAS | 118-91-2 |
| Molecular Weight (g/mol) | 156.565 |
| ChEBI | CHEBI:30793 |
| MDL Number | MFCD00002412 |
| SMILES | C1=CC=C(C(=C1)C(=O)O)Cl |
| Synonym | o-chlorobenzoic acid,benzoic acid, o-chloro,benzoic acid, 2-chloro,2-cba,kyselina o-chlorbenzoova,chlorobenzoic acid,ocba,benzoic acid, chloro,2-chloro-benzoic acid,chlorobenzoate |
| IUPAC Name | 2-chlorobenzoic acid |
| InChI Key | IKCLCGXPQILATA-UHFFFAOYSA-N |
| Molecular Formula | C7H5ClO2 |
3-Methylbenzoic anhydride, 97%
CAS: 21436-44-2 Molecular Formula: C16H14O3 Molecular Weight (g/mol): 254.285 MDL Number: MFCD00048083 InChI Key: DGZSQLHPEZFGSI-UHFFFAOYSA-N Synonym: 3-methylbenzoic anhydride,m-toluic anhydride,3-methylbenzene-1-carboxylic anhydride,benzoic acid, 3-methyl-, anhydride,3-methylbenzene-1-carboxylicanhydride,3-methylbenzoicanhydride,bis 3-methylbenzoic acid anhydride,3-methylbenzoyl 3-methylbenzoate,benzoic acid,3-methyl-, 1,1'-anhydride PubChem CID: 253301 IUPAC Name: (3-methylbenzoyl) 3-methylbenzoate SMILES: CC1=CC=CC(=C1)C(=O)OC(=O)C2=CC(=CC=C2)C
| PubChem CID | 253301 |
|---|---|
| CAS | 21436-44-2 |
| Molecular Weight (g/mol) | 254.285 |
| MDL Number | MFCD00048083 |
| SMILES | CC1=CC=CC(=C1)C(=O)OC(=O)C2=CC(=CC=C2)C |
| Synonym | 3-methylbenzoic anhydride,m-toluic anhydride,3-methylbenzene-1-carboxylic anhydride,benzoic acid, 3-methyl-, anhydride,3-methylbenzene-1-carboxylicanhydride,3-methylbenzoicanhydride,bis 3-methylbenzoic acid anhydride,3-methylbenzoyl 3-methylbenzoate,benzoic acid,3-methyl-, 1,1'-anhydride |
| IUPAC Name | (3-methylbenzoyl) 3-methylbenzoate |
| InChI Key | DGZSQLHPEZFGSI-UHFFFAOYSA-N |
| Molecular Formula | C16H14O3 |
4-Benzoylbenzoic acid, 99%
CAS: 611-95-0 Molecular Formula: C14H10O3 Molecular Weight (g/mol): 226.23 MDL Number: MFCD00002560 InChI Key: IFQUPKAISSPFTE-UHFFFAOYSA-N Synonym: p-benzoylbenzoic acid,benzoic acid, 4-benzoyl,4-carboxybenzophenone,4-benzoyl-benzoic acid,4-phenylcarbonyl benzoic acid,benzoic acid, p-benzoyl,benzophenone-4-carboxylic acid,4-benzoyl benzoic acid,pubchem14544,acmc-209mpx PubChem CID: 69147 IUPAC Name: 4-benzoylbenzoic acid SMILES: C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(=O)O
| PubChem CID | 69147 |
|---|---|
| CAS | 611-95-0 |
| Molecular Weight (g/mol) | 226.23 |
| MDL Number | MFCD00002560 |
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(=O)O |
| Synonym | p-benzoylbenzoic acid,benzoic acid, 4-benzoyl,4-carboxybenzophenone,4-benzoyl-benzoic acid,4-phenylcarbonyl benzoic acid,benzoic acid, p-benzoyl,benzophenone-4-carboxylic acid,4-benzoyl benzoic acid,pubchem14544,acmc-209mpx |
| IUPAC Name | 4-benzoylbenzoic acid |
| InChI Key | IFQUPKAISSPFTE-UHFFFAOYSA-N |
| Molecular Formula | C14H10O3 |
4-Hydroxy-3-nitrobenzoic acid, 98%
CAS: 616-82-0 Molecular Formula: C7H5NO5 Molecular Weight (g/mol): 183.12 MDL Number: MFCD00007119 InChI Key: QRYSWXFQLFLJTC-UHFFFAOYSA-N Synonym: 4-hydroxy-3-nitrobenzoic acid,3-nitro-4-hydroxybenzoic acid,benzoic acid, 4-hydroxy-3-nitro,3-nitro-4-hydrobenzoic acid,4-hydroxy-3-nitro-benzoic acid,nhb,pubchem18981,acmc-1auqv,3,4-nitrohydroxybenzoic acid,ksc489q0p PubChem CID: 12033 IUPAC Name: 4-hydroxy-3-nitrobenzoic acid SMILES: OC(=O)C1=CC=C(O)C(=C1)[N+]([O-])=O
| PubChem CID | 12033 |
|---|---|
| CAS | 616-82-0 |
| Molecular Weight (g/mol) | 183.12 |
| MDL Number | MFCD00007119 |
| SMILES | OC(=O)C1=CC=C(O)C(=C1)[N+]([O-])=O |
| Synonym | 4-hydroxy-3-nitrobenzoic acid,3-nitro-4-hydroxybenzoic acid,benzoic acid, 4-hydroxy-3-nitro,3-nitro-4-hydrobenzoic acid,4-hydroxy-3-nitro-benzoic acid,nhb,pubchem18981,acmc-1auqv,3,4-nitrohydroxybenzoic acid,ksc489q0p |
| IUPAC Name | 4-hydroxy-3-nitrobenzoic acid |
| InChI Key | QRYSWXFQLFLJTC-UHFFFAOYSA-N |
| Molecular Formula | C7H5NO5 |
Ethyl 4-hydroxybenzoate, 99%
CAS: 120-47-8 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00002353 InChI Key: NUVBSKCKDOMJSU-UHFFFAOYSA-N Synonym: ethylparaben,ethyl paraben,ethyl p-hydroxybenzoate,mycocten,ethyl parasept,4-hydroxybenzoic acid ethyl ester,easeptol,ethyl butex,ethyl parahydroxybenzoate,tegosept e PubChem CID: 8434 ChEBI: CHEBI:86616 IUPAC Name: ethyl 4-hydroxybenzoate SMILES: CCOC(=O)C1=CC=C(C=C1)O
| PubChem CID | 8434 |
|---|---|
| CAS | 120-47-8 |
| Molecular Weight (g/mol) | 166.18 |
| ChEBI | CHEBI:86616 |
| MDL Number | MFCD00002353 |
| SMILES | CCOC(=O)C1=CC=C(C=C1)O |
| Synonym | ethylparaben,ethyl paraben,ethyl p-hydroxybenzoate,mycocten,ethyl parasept,4-hydroxybenzoic acid ethyl ester,easeptol,ethyl butex,ethyl parahydroxybenzoate,tegosept e |
| IUPAC Name | ethyl 4-hydroxybenzoate |
| InChI Key | NUVBSKCKDOMJSU-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
alpha-Methylstyrene (stabilized with TBC) 99.0+%, TCI America™
CAS: 98-83-9 Molecular Formula: C9H10 Molecular Weight (g/mol): 118.18 MDL Number: MFCD00008859 InChI Key: XYLMUPLGERFSHI-UHFFFAOYSA-N Synonym: alpha-methylstyrene,2-phenylpropene,2-phenyl-1-propene,isopropenylbenzene,benzene, 1-methylethenyl,2-phenylpropylene,1-methyl-1-phenylethylene,alpha-methylstyrol,as-methylphenylethylene,1-phenyl-1-methylethylene PubChem CID: 7407 ChEBI: CHEBI:35060 IUPAC Name: (prop-1-en-2-yl)benzene SMILES: CC(=C)C1=CC=CC=C1
| PubChem CID | 7407 |
|---|---|
| CAS | 98-83-9 |
| Molecular Weight (g/mol) | 118.18 |
| ChEBI | CHEBI:35060 |
| MDL Number | MFCD00008859 |
| SMILES | CC(=C)C1=CC=CC=C1 |
| Synonym | alpha-methylstyrene,2-phenylpropene,2-phenyl-1-propene,isopropenylbenzene,benzene, 1-methylethenyl,2-phenylpropylene,1-methyl-1-phenylethylene,alpha-methylstyrol,as-methylphenylethylene,1-phenyl-1-methylethylene |
| IUPAC Name | (prop-1-en-2-yl)benzene |
| InChI Key | XYLMUPLGERFSHI-UHFFFAOYSA-N |
| Molecular Formula | C9H10 |
Thermo Scientific Chemicals Iodonitrotetrazolium chloride, 98%
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: 2-(4-iodophenyl)-3-(4-nitrophenyl)-5-phenyltetrazol-2-ium;chloride SMILES: [Cl-].[O-][N+](=O)C1=CC=C(C=C1)[N+]1=NC(=NN1C1=CC=C(I)C=C1)C1=CC=CC=C1
| PubChem CID | 64957 |
|---|---|
| CAS | 146-68-9 |
| Molecular Weight (g/mol) | 505.70 |
| ChEBI | CHEBI:75421 |
| MDL Number | MFCD00011961,MFCD00149999 |
| SMILES | [Cl-].[O-][N+](=O)C1=CC=C(C=C1)[N+]1=NC(=NN1C1=CC=C(I)C=C1)C1=CC=CC=C1 |
| 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 |
| IUPAC Name | 2-(4-iodophenyl)-3-(4-nitrophenyl)-5-phenyltetrazol-2-ium;chloride |
| InChI Key | JORABGDXCIBAFL-UHFFFAOYSA-M |
| Molecular Formula | C19H13ClIN5O2 |
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
| PubChem CID | 7184 |
|---|---|
| CAS | 94-26-8 |
| Molecular Weight (g/mol) | 194.23 |
| MDL Number | MFCD00016478 |
| SMILES | CCCCOC(=O)C1=CC=C(C=C1)O |
| Synonym | butylparaben,butyl paraben,butyl p-hydroxybenzoate,nipabutyl,butoben,butyl chemosept,butyl parasept,butyl tegosept,butyl butex,tegosept butyl |
| IUPAC Name | butyl 4-hydroxybenzoate |
| InChI Key | QFOHBWFCKVYLES-UHFFFAOYSA-N |
| Molecular Formula | C11H14O3 |
Tolylene-2,4-diisocyanate 98.0+%, TCI America™
CAS: 584-84-9 Molecular Formula: C9H6N2O2 Molecular Weight (g/mol): 174.159 MDL Number: MFCD00002011 InChI Key: DVKJHBMWWAPEIU-UHFFFAOYSA-N Synonym: 2,4-toluene diisocyanate,2,4-diisocyanatotoluene,tolylene-2,4-diisocyanate,toluene-2,4-diisocyanate,2,4-tolylene diisocyanate,toluene 2,4-diisocyanate,4-methyl-m-phenylene diisocyanate,tolylene diisocyanate,2,4-tdi,toluylene-2,4-diisocyanate PubChem CID: 11443 ChEBI: CHEBI:53556 IUPAC Name: 2,4-diisocyanato-1-methylbenzene SMILES: CC1=C(C=C(C=C1)N=C=O)N=C=O
| PubChem CID | 11443 |
|---|---|
| CAS | 584-84-9 |
| Molecular Weight (g/mol) | 174.159 |
| ChEBI | CHEBI:53556 |
| MDL Number | MFCD00002011 |
| SMILES | CC1=C(C=C(C=C1)N=C=O)N=C=O |
| Synonym | 2,4-toluene diisocyanate,2,4-diisocyanatotoluene,tolylene-2,4-diisocyanate,toluene-2,4-diisocyanate,2,4-tolylene diisocyanate,toluene 2,4-diisocyanate,4-methyl-m-phenylene diisocyanate,tolylene diisocyanate,2,4-tdi,toluylene-2,4-diisocyanate |
| IUPAC Name | 2,4-diisocyanato-1-methylbenzene |
| InChI Key | DVKJHBMWWAPEIU-UHFFFAOYSA-N |
| Molecular Formula | C9H6N2O2 |
Terephthaldicarboxaldehyde, 98%
CAS: 623-27-8 Molecular Formula: C8H6O2 Molecular Weight (g/mol): 134.13 MDL Number: MFCD00006949 InChI Key: KUCOHFSKRZZVRO-UHFFFAOYSA-N Synonym: 1,4-benzenedicarboxaldehyde,p-phthalaldehyde,terephthaldehyde,terephthaldialdehyde,terephthaladehyde,terephthaldicarboxaldehyde,terephthalic aldehyde,1,4-phthalaldehyde,p-formylbenzaldehyde,terephtaldehyde PubChem CID: 12173 IUPAC Name: terephthalaldehyde SMILES: C1=CC(=CC=C1C=O)C=O
| PubChem CID | 12173 |
|---|---|
| CAS | 623-27-8 |
| Molecular Weight (g/mol) | 134.13 |
| MDL Number | MFCD00006949 |
| SMILES | C1=CC(=CC=C1C=O)C=O |
| Synonym | 1,4-benzenedicarboxaldehyde,p-phthalaldehyde,terephthaldehyde,terephthaldialdehyde,terephthaladehyde,terephthaldicarboxaldehyde,terephthalic aldehyde,1,4-phthalaldehyde,p-formylbenzaldehyde,terephtaldehyde |
| IUPAC Name | terephthalaldehyde |
| InChI Key | KUCOHFSKRZZVRO-UHFFFAOYSA-N |
| Molecular Formula | C8H6O2 |
4-Bromobenzaldehyde 97.0+%, TCI America™
CAS: 1122-91-4 Molecular Formula: C7H5BrO Molecular Weight (g/mol): 185.02 MDL Number: MFCD00003377 InChI Key: ZRYZBQLXDKPBDU-UHFFFAOYSA-N Synonym: p-bromobenzaldehyde,benzaldehyde, 4-bromo,benzaldehyde, p-bromo,4-bromo-benzaldehyde,4-bromo benzaldehyde,4-bromobenzylaldehyde,p-bromo benzaldehyde,unii-4l8vm24f65,4-brombenzaldehyde,4-brombenzaldehyd PubChem CID: 70741 IUPAC Name: 4-bromobenzaldehyde SMILES: C1=CC(=CC=C1C=O)Br
| PubChem CID | 70741 |
|---|---|
| CAS | 1122-91-4 |
| Molecular Weight (g/mol) | 185.02 |
| MDL Number | MFCD00003377 |
| SMILES | C1=CC(=CC=C1C=O)Br |
| Synonym | p-bromobenzaldehyde,benzaldehyde, 4-bromo,benzaldehyde, p-bromo,4-bromo-benzaldehyde,4-bromo benzaldehyde,4-bromobenzylaldehyde,p-bromo benzaldehyde,unii-4l8vm24f65,4-brombenzaldehyde,4-brombenzaldehyd |
| IUPAC Name | 4-bromobenzaldehyde |
| InChI Key | ZRYZBQLXDKPBDU-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrO |
Benzyl n-butyl phthalate, 98%
CAS: 85-68-7 Molecular Formula: C19H20O4 Molecular Weight (g/mol): 312.365 MDL Number: MFCD00009440 InChI Key: IRIAEXORFWYRCZ-UHFFFAOYSA-N Synonym: benzyl butyl phthalate,butyl benzyl phthalate,sicol,palatinol bb,unimoll bb,santicizer 160,butylbenzyl phthalate,n-butyl benzyl phthalate,sicol 160,benzyl n-butyl phthalate PubChem CID: 2347 ChEBI: CHEBI:34595 IUPAC Name: 2-O-benzyl 1-O-butyl benzene-1,2-dicarboxylate SMILES: CCCCOC(=O)C1=CC=CC=C1C(=O)OCC2=CC=CC=C2
| PubChem CID | 2347 |
|---|---|
| CAS | 85-68-7 |
| Molecular Weight (g/mol) | 312.365 |
| ChEBI | CHEBI:34595 |
| MDL Number | MFCD00009440 |
| SMILES | CCCCOC(=O)C1=CC=CC=C1C(=O)OCC2=CC=CC=C2 |
| Synonym | benzyl butyl phthalate,butyl benzyl phthalate,sicol,palatinol bb,unimoll bb,santicizer 160,butylbenzyl phthalate,n-butyl benzyl phthalate,sicol 160,benzyl n-butyl phthalate |
| IUPAC Name | 2-O-benzyl 1-O-butyl benzene-1,2-dicarboxylate |
| InChI Key | IRIAEXORFWYRCZ-UHFFFAOYSA-N |
| Molecular Formula | C19H20O4 |
4-Fluorophenylboronic acid, 97%
CAS: 1765-93-1 Molecular Formula: C6H6BFO2 Molecular Weight (g/mol): 139.92 MDL Number: MFCD00039136 InChI Key: LBUNNMJLXWQQBY-UHFFFAOYSA-N Synonym: 4-fluorobenzeneboronic acid,4-fluorophenyl boronic acid,4-fluorophenyl boranediol,p-fluorophenylboronic acid,4-fluorophenylbornic acid,4-fluorophenyl dihydroxyboron,4-fluorophenyl dihydroxyborane,p-fluorophenyl boric acid,4-fluorophenyl boric acid PubChem CID: 285645 ChEBI: CHEBI:48661 IUPAC Name: (4-fluorophenyl)boronic acid SMILES: OB(O)C1=CC=C(F)C=C1
| PubChem CID | 285645 |
|---|---|
| CAS | 1765-93-1 |
| Molecular Weight (g/mol) | 139.92 |
| ChEBI | CHEBI:48661 |
| MDL Number | MFCD00039136 |
| SMILES | OB(O)C1=CC=C(F)C=C1 |
| Synonym | 4-fluorobenzeneboronic acid,4-fluorophenyl boronic acid,4-fluorophenyl boranediol,p-fluorophenylboronic acid,4-fluorophenylbornic acid,4-fluorophenyl dihydroxyboron,4-fluorophenyl dihydroxyborane,p-fluorophenyl boric acid,4-fluorophenyl boric acid |
| IUPAC Name | (4-fluorophenyl)boronic acid |
| InChI Key | LBUNNMJLXWQQBY-UHFFFAOYSA-N |
| Molecular Formula | C6H6BFO2 |
4-Fluorobenzylamine, 98+%
CAS: 140-75-0 Molecular Formula: C7H8FN Molecular Weight (g/mol): 125.146 MDL Number: MFCD00008120 InChI Key: IIFVWLUQBAIPMJ-UHFFFAOYSA-N Synonym: 4-fluorobenzylamine,4-fluorophenyl methanamine,benzenemethanamine, 4-fluoro,p-fluorobenzylamine,benzylamine, p-fluoro,p-fluorobenzyl amine,4-fluoro-benzylamine,1-4-fluorophenyl methanamine,4-fluorobenzyl amine,chembl12392 PubChem CID: 67326 IUPAC Name: (4-fluorophenyl)methanamine SMILES: C1=CC(=CC=C1CN)F
| PubChem CID | 67326 |
|---|---|
| CAS | 140-75-0 |
| Molecular Weight (g/mol) | 125.146 |
| MDL Number | MFCD00008120 |
| SMILES | C1=CC(=CC=C1CN)F |
| Synonym | 4-fluorobenzylamine,4-fluorophenyl methanamine,benzenemethanamine, 4-fluoro,p-fluorobenzylamine,benzylamine, p-fluoro,p-fluorobenzyl amine,4-fluoro-benzylamine,1-4-fluorophenyl methanamine,4-fluorobenzyl amine,chembl12392 |
| IUPAC Name | (4-fluorophenyl)methanamine |
| InChI Key | IIFVWLUQBAIPMJ-UHFFFAOYSA-N |
| Molecular Formula | C7H8FN |