Benzene and substituted derivatives
Filtered Search Results
4-Bromophenylacetic acid, 99%
CAS: 1878-68-8 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.05 MDL Number: MFCD00004342 InChI Key: QOWSWEBLNVACCL-UHFFFAOYSA-N Synonym: 4-bromophenylacetic acid,2-4-bromophenyl acetic acid,4-bromophenyl acetic acid,p-bromophenylacetic acid,4-bromobenzeneacetic acid,benzeneacetic acid, 4-bromo,p-bromophenyl acetic acid,acetic acid, p-bromophenyl,p-bromphenylessigsaure german PubChem CID: 74654 ChEBI: CHEBI:1790 IUPAC Name: 2-(4-bromophenyl)acetic acid SMILES: OC(=O)CC1=CC=C(Br)C=C1
| PubChem CID | 74654 |
|---|---|
| CAS | 1878-68-8 |
| Molecular Weight (g/mol) | 215.05 |
| ChEBI | CHEBI:1790 |
| MDL Number | MFCD00004342 |
| SMILES | OC(=O)CC1=CC=C(Br)C=C1 |
| Synonym | 4-bromophenylacetic acid,2-4-bromophenyl acetic acid,4-bromophenyl acetic acid,p-bromophenylacetic acid,4-bromobenzeneacetic acid,benzeneacetic acid, 4-bromo,p-bromophenyl acetic acid,acetic acid, p-bromophenyl,p-bromphenylessigsaure german |
| IUPAC Name | 2-(4-bromophenyl)acetic acid |
| InChI Key | QOWSWEBLNVACCL-UHFFFAOYSA-N |
| Molecular Formula | C8H7BrO2 |
3-Nitrophthalic acid, 95%
CAS: 603-11-2 Molecular Formula: C8H5NO6 Molecular Weight (g/mol): 211.129 MDL Number: MFCD00007138 InChI Key: KFIRODWJCYBBHY-UHFFFAOYSA-N Synonym: 3-nitrophthalic acid,3-nitrobenzene-1,2-dicarboxylic acid,phthalic acid, 3-nitro,1,2-benzenedicarboxylic acid, 3-nitro,3-nitro phthalic acid,3-nitro-phthalic acid,3-nitrophthalicacid,nitrophthalic acid,3-nitrophtalic acid,m-nitrophthalic acid PubChem CID: 69043 SMILES: C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)O)C(=O)O
| PubChem CID | 69043 |
|---|---|
| CAS | 603-11-2 |
| Molecular Weight (g/mol) | 211.129 |
| MDL Number | MFCD00007138 |
| SMILES | C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)O)C(=O)O |
| Synonym | 3-nitrophthalic acid,3-nitrobenzene-1,2-dicarboxylic acid,phthalic acid, 3-nitro,1,2-benzenedicarboxylic acid, 3-nitro,3-nitro phthalic acid,3-nitro-phthalic acid,3-nitrophthalicacid,nitrophthalic acid,3-nitrophtalic acid,m-nitrophthalic acid |
| InChI Key | KFIRODWJCYBBHY-UHFFFAOYSA-N |
| Molecular Formula | C8H5NO6 |
Methyl 4-methoxybenzoate, 98+%
CAS: 121-98-2 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00008437 InChI Key: DDIZAANNODHTRB-UHFFFAOYSA-N Synonym: methyl anisate,methyl p-anisate,methyl p-methoxybenzoate,4-methoxybenzoic acid methyl ester,p-anisic acid, methyl ester,benzoic acid, 4-methoxy-, methyl ester,methyl 4-anisate,p-methoxybenzoic acid methyl ester,p-anisic acid methyl ester,benzoic acid, p-methoxy-, methyl ester PubChem CID: 8499 ChEBI: CHEBI:86903 IUPAC Name: methyl 4-methoxybenzoate SMILES: COC1=CC=C(C=C1)C(=O)OC
| PubChem CID | 8499 |
|---|---|
| CAS | 121-98-2 |
| Molecular Weight (g/mol) | 166.176 |
| ChEBI | CHEBI:86903 |
| MDL Number | MFCD00008437 |
| SMILES | COC1=CC=C(C=C1)C(=O)OC |
| Synonym | methyl anisate,methyl p-anisate,methyl p-methoxybenzoate,4-methoxybenzoic acid methyl ester,p-anisic acid, methyl ester,benzoic acid, 4-methoxy-, methyl ester,methyl 4-anisate,p-methoxybenzoic acid methyl ester,p-anisic acid methyl ester,benzoic acid, p-methoxy-, methyl ester |
| IUPAC Name | methyl 4-methoxybenzoate |
| InChI Key | DDIZAANNODHTRB-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
Isopropyl 4-hydroxybenzoate, 98%
CAS: 4191-73-5 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.20 MDL Number: MFCD00016468 InChI Key: CMHMMKSPYOOVGI-UHFFFAOYSA-N Synonym: isopropyl 4-hydroxybenzoate,isopropylparaben,isopropyl p-hydroxybenzoate,isopropyl paraben,p-hydroxybenzoic acid isopropyl ester,isopropylhydroxybenzoate,unii-a6eox47qk0,p-oxybenzoesaureisopropylester,4-hydroxybenzoic acid isopropyl ester,benzoic acid, 4-hydroxy-, 1-methylethyl ester PubChem CID: 20161 IUPAC Name: propan-2-yl 4-hydroxybenzoate SMILES: CC(C)OC(=O)C1=CC=C(O)C=C1
| PubChem CID | 20161 |
|---|---|
| CAS | 4191-73-5 |
| Molecular Weight (g/mol) | 180.20 |
| MDL Number | MFCD00016468 |
| SMILES | CC(C)OC(=O)C1=CC=C(O)C=C1 |
| Synonym | isopropyl 4-hydroxybenzoate,isopropylparaben,isopropyl p-hydroxybenzoate,isopropyl paraben,p-hydroxybenzoic acid isopropyl ester,isopropylhydroxybenzoate,unii-a6eox47qk0,p-oxybenzoesaureisopropylester,4-hydroxybenzoic acid isopropyl ester,benzoic acid, 4-hydroxy-, 1-methylethyl ester |
| IUPAC Name | propan-2-yl 4-hydroxybenzoate |
| InChI Key | CMHMMKSPYOOVGI-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
Phenylbis(2,4,6-trimethylbenzoyl)phosphine Oxide 96.0+%, TCI America™
CAS: 162881-26-7 Molecular Formula: C26H27O3P Molecular Weight (g/mol): 418.473 MDL Number: MFCD01863675 InChI Key: GUCYFKSBFREPBC-UHFFFAOYSA-N Synonym: BAPO PubChem CID: 164512 IUPAC Name: [phenyl-(2,4,6-trimethylbenzoyl)phosphoryl]-(2,4,6-trimethylphenyl)methanone SMILES: CC1=CC(=C(C(=C1)C)C(=O)P(=O)(C2=CC=CC=C2)C(=O)C3=C(C=C(C=C3C)C)C)C
| PubChem CID | 164512 |
|---|---|
| CAS | 162881-26-7 |
| Molecular Weight (g/mol) | 418.473 |
| MDL Number | MFCD01863675 |
| SMILES | CC1=CC(=C(C(=C1)C)C(=O)P(=O)(C2=CC=CC=C2)C(=O)C3=C(C=C(C=C3C)C)C)C |
| Synonym | BAPO |
| IUPAC Name | [phenyl-(2,4,6-trimethylbenzoyl)phosphoryl]-(2,4,6-trimethylphenyl)methanone |
| InChI Key | GUCYFKSBFREPBC-UHFFFAOYSA-N |
| Molecular Formula | C26H27O3P |
4-Hydrazinobenzenesulfonic acid hydrate, 98%
CAS: 98-71-5 Molecular Formula: C6H8N2O3S Molecular Weight (g/mol): 188.20 MDL Number: MFCD00025097 InChI Key: IOMZCWUHFGMSEJ-UHFFFAOYSA-N Synonym: 4-hydrazinobenzenesulfonic acid,phenylhydrazine-4-sulfonic acid,benzenesulfonic acid, 4-hydrazino,p-hydrazinobenzenesulfonic acid,p-sulfophenylhydrazine,4-sulfophenylhydrazine,4-hydrazinobenzenesulphonic acid,phenylhydrazinesulfonic acid,phenylhydrazine-p-sulfonic acid,sulfanilic acid, n-amino PubChem CID: 66825 IUPAC Name: 4-hydrazinylbenzenesulfonic acid SMILES: NNC1=CC=C(C=C1)S(O)(=O)=O
| PubChem CID | 66825 |
|---|---|
| CAS | 98-71-5 |
| Molecular Weight (g/mol) | 188.20 |
| MDL Number | MFCD00025097 |
| SMILES | NNC1=CC=C(C=C1)S(O)(=O)=O |
| Synonym | 4-hydrazinobenzenesulfonic acid,phenylhydrazine-4-sulfonic acid,benzenesulfonic acid, 4-hydrazino,p-hydrazinobenzenesulfonic acid,p-sulfophenylhydrazine,4-sulfophenylhydrazine,4-hydrazinobenzenesulphonic acid,phenylhydrazinesulfonic acid,phenylhydrazine-p-sulfonic acid,sulfanilic acid, n-amino |
| IUPAC Name | 4-hydrazinylbenzenesulfonic acid |
| InChI Key | IOMZCWUHFGMSEJ-UHFFFAOYSA-N |
| Molecular Formula | C6H8N2O3S |
3,4-Dimethylbenzaldehyde, 97%
CAS: 5973-71-7 Molecular Formula: C9H10O Molecular Weight (g/mol): 134.18 MDL Number: MFCD00016612 InChI Key: POQJHLBMLVTHAU-UHFFFAOYSA-N Synonym: benzaldehyde, 3,4-dimethyl,unii-16g1j12arb,4-formyl-o-xylene,o-xylene-4-carboxaldehyde,3,4-dimethyl-benzaldehyde,3 pound not4-dimethylbenzaldehyde,pubchem2535,3,4 dimethyl benzaldehyde,3,4-di-methylbenzaldehyde,3,4-dimethyl benzaldehyde PubChem CID: 22278 IUPAC Name: 3,4-dimethylbenzaldehyde SMILES: CC1=C(C=C(C=C1)C=O)C
| PubChem CID | 22278 |
|---|---|
| CAS | 5973-71-7 |
| Molecular Weight (g/mol) | 134.18 |
| MDL Number | MFCD00016612 |
| SMILES | CC1=C(C=C(C=C1)C=O)C |
| Synonym | benzaldehyde, 3,4-dimethyl,unii-16g1j12arb,4-formyl-o-xylene,o-xylene-4-carboxaldehyde,3,4-dimethyl-benzaldehyde,3 pound not4-dimethylbenzaldehyde,pubchem2535,3,4 dimethyl benzaldehyde,3,4-di-methylbenzaldehyde,3,4-dimethyl benzaldehyde |
| IUPAC Name | 3,4-dimethylbenzaldehyde |
| InChI Key | POQJHLBMLVTHAU-UHFFFAOYSA-N |
| Molecular Formula | C9H10O |
4,4'-Dichlorobenzophenone, 99%
CAS: 90-98-2 Molecular Formula: C13H8Cl2O Molecular Weight (g/mol): 251.11 MDL Number: MFCD00000623 InChI Key: OKISUZLXOYGIFP-UHFFFAOYSA-N Synonym: 4,4'-dichlorobenzophenone,bis 4-chlorophenyl methanone,methanone, bis 4-chlorophenyl,bis 4-chlorophenyl ketone,dcbp,di p-chlorophenyl ketone,di 4-chlorophenyl ketone,bis p-chlorophenyl ketone,p,p'-dichlorobenzophenone,usaf do-4 PubChem CID: 7034 ChEBI: CHEBI:27519 IUPAC Name: bis(4-chlorophenyl)methanone SMILES: ClC1=CC=C(C=C1)C(=O)C1=CC=C(Cl)C=C1
| PubChem CID | 7034 |
|---|---|
| CAS | 90-98-2 |
| Molecular Weight (g/mol) | 251.11 |
| ChEBI | CHEBI:27519 |
| MDL Number | MFCD00000623 |
| SMILES | ClC1=CC=C(C=C1)C(=O)C1=CC=C(Cl)C=C1 |
| Synonym | 4,4'-dichlorobenzophenone,bis 4-chlorophenyl methanone,methanone, bis 4-chlorophenyl,bis 4-chlorophenyl ketone,dcbp,di p-chlorophenyl ketone,di 4-chlorophenyl ketone,bis p-chlorophenyl ketone,p,p'-dichlorobenzophenone,usaf do-4 |
| IUPAC Name | bis(4-chlorophenyl)methanone |
| InChI Key | OKISUZLXOYGIFP-UHFFFAOYSA-N |
| Molecular Formula | C13H8Cl2O |
Veratrole, 99+%
CAS: 91-16-7 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.17 MDL Number: MFCD00008357 InChI Key: ABDKAPXRBAPSQN-UHFFFAOYSA-N Synonym: veratrole,veratrol,pyrocatechol dimethyl ether,o-dimethoxybenzene,catechol dimethyl ether,benzene, 1,2-dimethoxy,2-methoxyanisole,o,o-dimethyl catechol,2-dimethoxybenzol,benzene, o-dimethoxy PubChem CID: 7043 ChEBI: CHEBI:59114 IUPAC Name: 1,2-dimethoxybenzene SMILES: COC1=CC=CC=C1OC
| PubChem CID | 7043 |
|---|---|
| CAS | 91-16-7 |
| Molecular Weight (g/mol) | 138.17 |
| ChEBI | CHEBI:59114 |
| MDL Number | MFCD00008357 |
| SMILES | COC1=CC=CC=C1OC |
| Synonym | veratrole,veratrol,pyrocatechol dimethyl ether,o-dimethoxybenzene,catechol dimethyl ether,benzene, 1,2-dimethoxy,2-methoxyanisole,o,o-dimethyl catechol,2-dimethoxybenzol,benzene, o-dimethoxy |
| IUPAC Name | 1,2-dimethoxybenzene |
| InChI Key | ABDKAPXRBAPSQN-UHFFFAOYSA-N |
| Molecular Formula | C8H10O2 |
Ethyl Benzoate, 99+%
CAS: 93-89-0 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00009109 InChI Key: MTZQAGJQAFMTAQ-UHFFFAOYSA-N Synonym: benzoic acid, ethyl ester,benzoic ether,ethyl benzenecarboxylate,ethylbenzoate,benzoyl ethyl ether,benzoic acid ethyl ester,ethylester kyseliny benzoove,natural,unii-j115brj15h,fema no. 2422 PubChem CID: 7165 IUPAC Name: ethyl benzoate SMILES: CCOC(=O)C1=CC=CC=C1
| PubChem CID | 7165 |
|---|---|
| CAS | 93-89-0 |
| Molecular Weight (g/mol) | 150.18 |
| MDL Number | MFCD00009109 |
| SMILES | CCOC(=O)C1=CC=CC=C1 |
| Synonym | benzoic acid, ethyl ester,benzoic ether,ethyl benzenecarboxylate,ethylbenzoate,benzoyl ethyl ether,benzoic acid ethyl ester,ethylester kyseliny benzoove,natural,unii-j115brj15h,fema no. 2422 |
| IUPAC Name | ethyl benzoate |
| InChI Key | MTZQAGJQAFMTAQ-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
Tetraphenylphosphonium bromide, 99%
CAS: 2751-90-8 Molecular Formula: C24H20BrP Molecular Weight (g/mol): 419.30 MDL Number: MFCD00011915 InChI Key: BRKFQVAOMSWFDU-UHFFFAOYSA-M Synonym: tetraphenylphosphonium bromide,phosphonium, tetraphenyl-, bromide,tetraphenylphosphoniumbromide,tetraphenylphosponium bromide,tetraphenylphosphanium bromide,phosphonium, tetraphenyl-, bromide 1:1,ph4pbr,bromotetraphenylphosphorane,acmc-1ce9k,tetraphenylphosphorus bromide PubChem CID: 2724163 IUPAC Name: tetraphenylphosphanium;bromide SMILES: [Br-].C1=CC=C(C=C1)[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 2724163 |
|---|---|
| CAS | 2751-90-8 |
| Molecular Weight (g/mol) | 419.30 |
| MDL Number | MFCD00011915 |
| SMILES | [Br-].C1=CC=C(C=C1)[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | tetraphenylphosphonium bromide,phosphonium, tetraphenyl-, bromide,tetraphenylphosphoniumbromide,tetraphenylphosponium bromide,tetraphenylphosphanium bromide,phosphonium, tetraphenyl-, bromide 1:1,ph4pbr,bromotetraphenylphosphorane,acmc-1ce9k,tetraphenylphosphorus bromide |
| IUPAC Name | tetraphenylphosphanium;bromide |
| InChI Key | BRKFQVAOMSWFDU-UHFFFAOYSA-M |
| Molecular Formula | C24H20BrP |
GBR 12909 dihydrochloride, Thermo Scientific Chemicals
CAS: 67469-78-7 Molecular Formula: C28H34Cl2F2N2O Molecular Weight (g/mol): 523.49 MDL Number: MFCD00055193 InChI Key: MIBSKSYCRFWIRU-UHFFFAOYSA-N PubChem CID: 104920 ChEBI: CHEBI:64086 IUPAC Name: 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-(3-phenylpropyl)piperazine;dihydrochloride SMILES: C1CN(CCN1CCCC2=CC=CC=C2)CCOC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F.Cl.Cl
| PubChem CID | 104920 |
|---|---|
| CAS | 67469-78-7 |
| Molecular Weight (g/mol) | 523.49 |
| ChEBI | CHEBI:64086 |
| MDL Number | MFCD00055193 |
| SMILES | C1CN(CCN1CCCC2=CC=CC=C2)CCOC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F.Cl.Cl |
| IUPAC Name | 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-(3-phenylpropyl)piperazine;dihydrochloride |
| InChI Key | MIBSKSYCRFWIRU-UHFFFAOYSA-N |
| Molecular Formula | C28H34Cl2F2N2O |
Benzhydryl bromide, 90+%
CAS: 776-74-9 Molecular Formula: C13H11Br Molecular Weight (g/mol): 247.135 MDL Number: MFCD00000134 InChI Key: OQROAIRCEOBYJA-UHFFFAOYSA-N Synonym: bromodiphenylmethane,benzhydryl bromide,diphenylmethyl bromide,diphenylbromomethane,alpha-bromodiphenylmethane,bromo phenyl methyl benzene,benzene, 1,1'-bromomethylene bis,methane, bromodiphenyl,bromomethylene dibenzene,bromodiphenyl methane PubChem CID: 236603 IUPAC Name: [bromo(phenyl)methyl]benzene SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)Br
| PubChem CID | 236603 |
|---|---|
| CAS | 776-74-9 |
| Molecular Weight (g/mol) | 247.135 |
| MDL Number | MFCD00000134 |
| SMILES | C1=CC=C(C=C1)C(C2=CC=CC=C2)Br |
| Synonym | bromodiphenylmethane,benzhydryl bromide,diphenylmethyl bromide,diphenylbromomethane,alpha-bromodiphenylmethane,bromo phenyl methyl benzene,benzene, 1,1'-bromomethylene bis,methane, bromodiphenyl,bromomethylene dibenzene,bromodiphenyl methane |
| IUPAC Name | [bromo(phenyl)methyl]benzene |
| InChI Key | OQROAIRCEOBYJA-UHFFFAOYSA-N |
| Molecular Formula | C13H11Br |
3-Aminobenzotrifluoride, 98%
CAS: 98-16-8 Molecular Formula: C7H6F3N Molecular Weight (g/mol): 161.13 MDL Number: MFCD00007797 InChI Key: VIUDTWATMPPKEL-UHFFFAOYSA-N Synonym: 3-trifluoromethyl aniline,3-aminobenzotrifluoride,m-aminobenzotrifluoride,3-aminotrifluorotoluene,benzenamine, 3-trifluoromethyl,3-trifluoromethyl benzenamine,m-abtf,m-trifluoromethylaniline,m-amino trifluorotoluene,m-trifluoromethyl aniline PubChem CID: 7375 IUPAC Name: 3-(trifluoromethyl)aniline SMILES: C1=CC(=CC(=C1)N)C(F)(F)F
| PubChem CID | 7375 |
|---|---|
| CAS | 98-16-8 |
| Molecular Weight (g/mol) | 161.13 |
| MDL Number | MFCD00007797 |
| SMILES | C1=CC(=CC(=C1)N)C(F)(F)F |
| Synonym | 3-trifluoromethyl aniline,3-aminobenzotrifluoride,m-aminobenzotrifluoride,3-aminotrifluorotoluene,benzenamine, 3-trifluoromethyl,3-trifluoromethyl benzenamine,m-abtf,m-trifluoromethylaniline,m-amino trifluorotoluene,m-trifluoromethyl aniline |
| IUPAC Name | 3-(trifluoromethyl)aniline |
| InChI Key | VIUDTWATMPPKEL-UHFFFAOYSA-N |
| Molecular Formula | C7H6F3N |
Diethyl phthalate, 99%
CAS: 84-66-2 Molecular Formula: C12H14O4 Molecular Weight (g/mol): 222.24 MDL Number: MFCD00009111 InChI Key: FLKPEMZONWLCSK-UHFFFAOYSA-N Synonym: diethyl phthalate,phthalic acid diethyl ester,ethyl phthalate,anozol,neantine,phthalol,solvanol,diethyl o-phthalate,palatinol a,placidol e PubChem CID: 6781 ChEBI: CHEBI:34698 IUPAC Name: diethyl benzene-1,2-dicarboxylate SMILES: CCOC(=O)C1=CC=CC=C1C(=O)OCC
| PubChem CID | 6781 |
|---|---|
| CAS | 84-66-2 |
| Molecular Weight (g/mol) | 222.24 |
| ChEBI | CHEBI:34698 |
| MDL Number | MFCD00009111 |
| SMILES | CCOC(=O)C1=CC=CC=C1C(=O)OCC |
| Synonym | diethyl phthalate,phthalic acid diethyl ester,ethyl phthalate,anozol,neantine,phthalol,solvanol,diethyl o-phthalate,palatinol a,placidol e |
| IUPAC Name | diethyl benzene-1,2-dicarboxylate |
| InChI Key | FLKPEMZONWLCSK-UHFFFAOYSA-N |
| Molecular Formula | C12H14O4 |