Benzene and substituted derivatives
Filtered Search Results
2-Nitrobenzaldehyde 99.0+%, TCI America™
CAS: 552-89-6 Molecular Formula: C7H5NO3 Molecular Weight (g/mol): 151.121 MDL Number: MFCD00007132 InChI Key: CMWKITSNTDAEDT-UHFFFAOYSA-N Synonym: o-nitrobenzaldehyde,benzaldehyde, 2-nitro,nitrobenzaldehyde,benzaldehyde, o-nitro,2-nitro-benzaldehyde,2-formylnitrobenzene,ccris 2322,unii-48b18q9b8e,benzaldehyde, nitro,ortho-nitrobenzaldehyde PubChem CID: 11101 ChEBI: CHEBI:66927 IUPAC Name: 2-nitrobenzaldehyde SMILES: C1=CC=C(C(=C1)C=O)[N+](=O)[O-]
| PubChem CID | 11101 |
|---|---|
| CAS | 552-89-6 |
| Molecular Weight (g/mol) | 151.121 |
| ChEBI | CHEBI:66927 |
| MDL Number | MFCD00007132 |
| SMILES | C1=CC=C(C(=C1)C=O)[N+](=O)[O-] |
| Synonym | o-nitrobenzaldehyde,benzaldehyde, 2-nitro,nitrobenzaldehyde,benzaldehyde, o-nitro,2-nitro-benzaldehyde,2-formylnitrobenzene,ccris 2322,unii-48b18q9b8e,benzaldehyde, nitro,ortho-nitrobenzaldehyde |
| IUPAC Name | 2-nitrobenzaldehyde |
| InChI Key | CMWKITSNTDAEDT-UHFFFAOYSA-N |
| Molecular Formula | C7H5NO3 |
4-Nitrobenzyl Cyanide 98.0+%, TCI America™
CAS: 555-21-5 Molecular Formula: C8H6N2O2 Molecular Weight (g/mol): 162.148 MDL Number: MFCD00007372 InChI Key: PXNJGLAVKOXITN-UHFFFAOYSA-N Synonym: 4-nitrophenylacetonitrile,p-nitrophenylacetonitrile,benzeneacetonitrile, 4-nitro,4-nitrobenzyl cyanide,2-4-nitrophenyl acetonitrile,p-nitrobenzyl cyanide,p-nitrobenzylcyanide,4-nitrobenzeneacetonitrile,acetonitrile, p-nitrophenyl,p-nitrophenyl acetonitrile PubChem CID: 68386 IUPAC Name: 2-(4-nitrophenyl)acetonitrile SMILES: C1=CC(=CC=C1CC#N)[N+](=O)[O-]
| PubChem CID | 68386 |
|---|---|
| CAS | 555-21-5 |
| Molecular Weight (g/mol) | 162.148 |
| MDL Number | MFCD00007372 |
| SMILES | C1=CC(=CC=C1CC#N)[N+](=O)[O-] |
| Synonym | 4-nitrophenylacetonitrile,p-nitrophenylacetonitrile,benzeneacetonitrile, 4-nitro,4-nitrobenzyl cyanide,2-4-nitrophenyl acetonitrile,p-nitrobenzyl cyanide,p-nitrobenzylcyanide,4-nitrobenzeneacetonitrile,acetonitrile, p-nitrophenyl,p-nitrophenyl acetonitrile |
| IUPAC Name | 2-(4-nitrophenyl)acetonitrile |
| InChI Key | PXNJGLAVKOXITN-UHFFFAOYSA-N |
| Molecular Formula | C8H6N2O2 |
2-Nitroisophthalic Acid 95.0+%, TCI America™
CAS: 21161-11-5 Molecular Formula: C8H5NO6 Molecular Weight (g/mol): 211.129 MDL Number: MFCD00017007 InChI Key: CAHWDGJDQYAFHM-UHFFFAOYSA-N PubChem CID: 88806 SMILES: C1=CC(=C(C(=C1)C(=O)O)[N+](=O)[O-])C(=O)O
| PubChem CID | 88806 |
|---|---|
| CAS | 21161-11-5 |
| Molecular Weight (g/mol) | 211.129 |
| MDL Number | MFCD00017007 |
| SMILES | C1=CC(=C(C(=C1)C(=O)O)[N+](=O)[O-])C(=O)O |
| InChI Key | CAHWDGJDQYAFHM-UHFFFAOYSA-N |
| Molecular Formula | C8H5NO6 |
s-Diphenylcarbazone, ACS Reagent Grade, Ricca Chemical
CAS: 538-62-5 Molecular Formula: C13H12N4O Molecular Weight (g/mol): 240.266 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
| PubChem CID | 10860 |
|---|---|
| CAS | 538-62-5 |
| Molecular Weight (g/mol) | 240.266 |
| SMILES | C1=CC=C(C=C1)NNC(=O)N=NC2=CC=CC=C2 |
| 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 |
| IUPAC Name | 1-anilino-3-phenyliminourea |
| InChI Key | ZFWAHZCOKGWUIT-UHFFFAOYSA-N |
| Molecular Formula | C13H12N4O |
1-Heptyloxy-4-nitrobenzene, TCI America™
CAS: 13565-36-1 Molecular Formula: C13H19NO3 Molecular Weight (g/mol): 237.299 MDL Number: MFCD00024692 InChI Key: AVDKYVSWJDZALX-UHFFFAOYSA-N Synonym: Heptyl 4-Nitrophenyl Ether PubChem CID: 139499 IUPAC Name: 1-heptoxy-4-nitrobenzene SMILES: CCCCCCCOC1=CC=C(C=C1)[N+](=O)[O-]
| PubChem CID | 139499 |
|---|---|
| CAS | 13565-36-1 |
| Molecular Weight (g/mol) | 237.299 |
| MDL Number | MFCD00024692 |
| SMILES | CCCCCCCOC1=CC=C(C=C1)[N+](=O)[O-] |
| Synonym | Heptyl 4-Nitrophenyl Ether |
| IUPAC Name | 1-heptoxy-4-nitrobenzene |
| InChI Key | AVDKYVSWJDZALX-UHFFFAOYSA-N |
| Molecular Formula | C13H19NO3 |
Heptyltriphenylphosphonium Bromide 98.0+%, TCI America™
CAS: 13423-48-8 Molecular Formula: C25H30BrP Molecular Weight (g/mol): 441.39 MDL Number: MFCD00050249 InChI Key: WCZSOHSGMBVYFW-UHFFFAOYSA-M Synonym: heptyltriphenylphosphonium bromide,n-heptyltriphenylphosphonium bromide,heptyltriphenylphosphanium bromide,heptyl triphenyl phosphanium bromide,heptyl triphenyl phosphonium bromide,n-heptyl-triphenylphosphonium bromide,1-heptyl triphenylphosphonium bromide,phosphonium, heptyltriphenyl-, bromide,c7h15pph3br;,acmc-209bu9 PubChem CID: 2724567 IUPAC Name: heptyltriphenylphosphanium bromide SMILES: [Br-].CCCCCCC[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 2724567 |
|---|---|
| CAS | 13423-48-8 |
| Molecular Weight (g/mol) | 441.39 |
| MDL Number | MFCD00050249 |
| SMILES | [Br-].CCCCCCC[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | heptyltriphenylphosphonium bromide,n-heptyltriphenylphosphonium bromide,heptyltriphenylphosphanium bromide,heptyl triphenyl phosphanium bromide,heptyl triphenyl phosphonium bromide,n-heptyl-triphenylphosphonium bromide,1-heptyl triphenylphosphonium bromide,phosphonium, heptyltriphenyl-, bromide,c7h15pph3br;,acmc-209bu9 |
| IUPAC Name | heptyltriphenylphosphanium bromide |
| InChI Key | WCZSOHSGMBVYFW-UHFFFAOYSA-M |
| Molecular Formula | C25H30BrP |
Nitroterephthalic Acid 98.0+%, TCI America™
CAS: 610-29-7 Molecular Formula: C8H5NO6 Molecular Weight (g/mol): 211.129 MDL Number: MFCD00007141 InChI Key: QUMITRDILMWWBC-UHFFFAOYSA-N Synonym: nitroterephthalic acid,2-nitroterephthalic acid,2-nitrobenzene-1,4-dicarboxylic acid,1,4-benzenedicarboxylic acid, 2-nitro,terephthalic acid, nitro,2-nitroterephthalicacid,2-nitroterephthalate,5-nitroterephthalic acid,acmc-1au2u PubChem CID: 69122 SMILES: C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])C(=O)O
| PubChem CID | 69122 |
|---|---|
| CAS | 610-29-7 |
| Molecular Weight (g/mol) | 211.129 |
| MDL Number | MFCD00007141 |
| SMILES | C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])C(=O)O |
| Synonym | nitroterephthalic acid,2-nitroterephthalic acid,2-nitrobenzene-1,4-dicarboxylic acid,1,4-benzenedicarboxylic acid, 2-nitro,terephthalic acid, nitro,2-nitroterephthalicacid,2-nitroterephthalate,5-nitroterephthalic acid,acmc-1au2u |
| InChI Key | QUMITRDILMWWBC-UHFFFAOYSA-N |
| Molecular Formula | C8H5NO6 |
2,4,5-Trifluorobenzoyl Chloride 98.0+%, TCI America™
CAS: 88419-56-1 Molecular Formula: C7H2ClF3O Molecular Weight (g/mol): 194.54 MDL Number: MFCD00061204 InChI Key: STBGCAUUOPNJBH-UHFFFAOYSA-N Synonym: 2,4,5-trifluorobenzoylchloride,benzoyl chloride, 2,4,5-trifluoro,2,4,5-tris fluoranyl benzoyl chloride,pubchem9716,acmc-209qt0,2,4,5-trifluorobenzoyl-chloride,stbgcauuopnjbh-uhfffaoysa,timtec-bb sbb006657,2,4,5-trifluoro-benzoyl chloride,2,4,5-trifluorobenzoyl chloride PubChem CID: 145164 IUPAC Name: 2,4,5-trifluorobenzoyl chloride SMILES: FC1=CC(F)=C(C=C1F)C(Cl)=O
| PubChem CID | 145164 |
|---|---|
| CAS | 88419-56-1 |
| Molecular Weight (g/mol) | 194.54 |
| MDL Number | MFCD00061204 |
| SMILES | FC1=CC(F)=C(C=C1F)C(Cl)=O |
| Synonym | 2,4,5-trifluorobenzoylchloride,benzoyl chloride, 2,4,5-trifluoro,2,4,5-tris fluoranyl benzoyl chloride,pubchem9716,acmc-209qt0,2,4,5-trifluorobenzoyl-chloride,stbgcauuopnjbh-uhfffaoysa,timtec-bb sbb006657,2,4,5-trifluoro-benzoyl chloride,2,4,5-trifluorobenzoyl chloride |
| IUPAC Name | 2,4,5-trifluorobenzoyl chloride |
| InChI Key | STBGCAUUOPNJBH-UHFFFAOYSA-N |
| Molecular Formula | C7H2ClF3O |
Ethyl 2,4,6-Trimethylbenzoate 95.0+%, TCI America™
CAS: 1754-55-8 Molecular Formula: C12H16O2 Molecular Weight (g/mol): 192.258 MDL Number: MFCD00015439 InChI Key: ZXTXIZPSMQCYBN-UHFFFAOYSA-N Synonym: 2,4,6-Trimethylbenzoic Acid Ethyl Ester, Ethyl Mesitylenecarboxylate, Mesitylenecarboxylic Acid Ethyl Ester PubChem CID: 74465 IUPAC Name: ethyl 2,4,6-trimethylbenzoate SMILES: CCOC(=O)C1=C(C=C(C=C1C)C)C
| PubChem CID | 74465 |
|---|---|
| CAS | 1754-55-8 |
| Molecular Weight (g/mol) | 192.258 |
| MDL Number | MFCD00015439 |
| SMILES | CCOC(=O)C1=C(C=C(C=C1C)C)C |
| Synonym | 2,4,6-Trimethylbenzoic Acid Ethyl Ester, Ethyl Mesitylenecarboxylate, Mesitylenecarboxylic Acid Ethyl Ester |
| IUPAC Name | ethyl 2,4,6-trimethylbenzoate |
| InChI Key | ZXTXIZPSMQCYBN-UHFFFAOYSA-N |
| Molecular Formula | C12H16O2 |
5-Fluoro-2-nitroanisole 98.0+%, TCI America™
CAS: 448-19-1 Molecular Formula: C7H6FNO3 Molecular Weight (g/mol): 171.127 MDL Number: MFCD00077541 InChI Key: WLKUSVNHZXUEFO-UHFFFAOYSA-N Synonym: 4-Fluoro-2-methoxy-1-nitrobenzene PubChem CID: 2779250 IUPAC Name: 4-fluoro-2-methoxy-1-nitrobenzene SMILES: COC1=C(C=CC(=C1)F)[N+](=O)[O-]
| PubChem CID | 2779250 |
|---|---|
| CAS | 448-19-1 |
| Molecular Weight (g/mol) | 171.127 |
| MDL Number | MFCD00077541 |
| SMILES | COC1=C(C=CC(=C1)F)[N+](=O)[O-] |
| Synonym | 4-Fluoro-2-methoxy-1-nitrobenzene |
| IUPAC Name | 4-fluoro-2-methoxy-1-nitrobenzene |
| InChI Key | WLKUSVNHZXUEFO-UHFFFAOYSA-N |
| Molecular Formula | C7H6FNO3 |
3-Fluoro-4-n-octyloxybenzoic Acid 97.0+%, TCI America™
CAS: 326-78-3 Molecular Formula: C15H21FO3 Molecular Weight (g/mol): 268.328 MDL Number: MFCD00191649 InChI Key: SQVFTDZEUGEJTQ-UHFFFAOYSA-N PubChem CID: 593523 IUPAC Name: 3-fluoro-4-octoxybenzoic acid SMILES: CCCCCCCCOC1=C(C=C(C=C1)C(=O)O)F
| PubChem CID | 593523 |
|---|---|
| CAS | 326-78-3 |
| Molecular Weight (g/mol) | 268.328 |
| MDL Number | MFCD00191649 |
| SMILES | CCCCCCCCOC1=C(C=C(C=C1)C(=O)O)F |
| IUPAC Name | 3-fluoro-4-octoxybenzoic acid |
| InChI Key | SQVFTDZEUGEJTQ-UHFFFAOYSA-N |
| Molecular Formula | C15H21FO3 |
2-Bromo-5-methylbenzoic Acid 98.0+%, TCI America™
CAS: 6967-82-4 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.046 MDL Number: MFCD00079722 InChI Key: ZXMISUUIYPFORW-UHFFFAOYSA-N Synonym: 2-bromo-5-methyl-benzoic acid,6-bromo-m-toluic acid,2-bromo-5-methyl benzoic acid,benzoic acid, 2-bromo-5-methyl,4-bromo-3-carboxytoluene,pubchem2166,acmc-1b7tl,ksc357q9r,2-bromanyl-5-methyl-benzoic acid,2-bromo-5-methylbenzoic acid PubChem CID: 228080 IUPAC Name: 2-bromo-5-methylbenzoic acid SMILES: CC1=CC(=C(C=C1)Br)C(=O)O
| PubChem CID | 228080 |
|---|---|
| CAS | 6967-82-4 |
| Molecular Weight (g/mol) | 215.046 |
| MDL Number | MFCD00079722 |
| SMILES | CC1=CC(=C(C=C1)Br)C(=O)O |
| Synonym | 2-bromo-5-methyl-benzoic acid,6-bromo-m-toluic acid,2-bromo-5-methyl benzoic acid,benzoic acid, 2-bromo-5-methyl,4-bromo-3-carboxytoluene,pubchem2166,acmc-1b7tl,ksc357q9r,2-bromanyl-5-methyl-benzoic acid,2-bromo-5-methylbenzoic acid |
| IUPAC Name | 2-bromo-5-methylbenzoic acid |
| InChI Key | ZXMISUUIYPFORW-UHFFFAOYSA-N |
| Molecular Formula | C8H7BrO2 |
N2-(tert-Butoxycarbonyl)-4-fluoro-1,2-phenylenediamine 98.0+%, TCI America™
CAS: 362670-07-3 Molecular Formula: C11H15FN2O2 Molecular Weight (g/mol): 226.25 MDL Number: MFCD07787180 InChI Key: FELBQUPQCJZQQX-UHFFFAOYSA-N Synonym: N2-Boc-4-fluoro-1,2-phenylenediamine, tert-Butyl (2-Amino-5-fluorophenyl)carbamate, (2-Amino-5-fluorophenyl)carbamic Acid tert-Butyl Ester PubChem CID: 53420357 IUPAC Name: tert-butyl N-(2-amino-5-fluorophenyl)carbamate SMILES: CC(C)(C)OC(=O)NC1=C(N)C=CC(F)=C1
| PubChem CID | 53420357 |
|---|---|
| CAS | 362670-07-3 |
| Molecular Weight (g/mol) | 226.25 |
| MDL Number | MFCD07787180 |
| SMILES | CC(C)(C)OC(=O)NC1=C(N)C=CC(F)=C1 |
| Synonym | N2-Boc-4-fluoro-1,2-phenylenediamine, tert-Butyl (2-Amino-5-fluorophenyl)carbamate, (2-Amino-5-fluorophenyl)carbamic Acid tert-Butyl Ester |
| IUPAC Name | tert-butyl N-(2-amino-5-fluorophenyl)carbamate |
| InChI Key | FELBQUPQCJZQQX-UHFFFAOYSA-N |
| Molecular Formula | C11H15FN2O2 |
3,4-Dimethoxybenzoic Acid 98.0+%, TCI America™
CAS: 93-07-2 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.175 MDL Number: MFCD00002500 InChI Key: DAUAQNGYDSHRET-UHFFFAOYSA-N Synonym: veratric acid,benzoic acid, 3,4-dimethoxy,dimethylprotocatechuic acid,veratrylic acid,3,4-dimethylprotocatechuic acid,veratrumenoic acid,3,4-dimethoxy-benzoic acid,unii-1yy04e7rr4,3,4-dimethoxybenzoes PubChem CID: 7121 ChEBI: CHEBI:296881 IUPAC Name: 3,4-dimethoxybenzoic acid SMILES: COC1=C(C=C(C=C1)C(=O)O)OC
| PubChem CID | 7121 |
|---|---|
| CAS | 93-07-2 |
| Molecular Weight (g/mol) | 182.175 |
| ChEBI | CHEBI:296881 |
| MDL Number | MFCD00002500 |
| SMILES | COC1=C(C=C(C=C1)C(=O)O)OC |
| Synonym | veratric acid,benzoic acid, 3,4-dimethoxy,dimethylprotocatechuic acid,veratrylic acid,3,4-dimethylprotocatechuic acid,veratrumenoic acid,3,4-dimethoxy-benzoic acid,unii-1yy04e7rr4,3,4-dimethoxybenzoes |
| IUPAC Name | 3,4-dimethoxybenzoic acid |
| InChI Key | DAUAQNGYDSHRET-UHFFFAOYSA-N |
| Molecular Formula | C9H10O4 |
4-Bromophthalonitrile 97.0+%, TCI America™
CAS: 70484-01-4 Molecular Formula: C8H3BrN2 Molecular Weight (g/mol): 207.03 MDL Number: MFCD00221794 InChI Key: ARAONWRSVQOHIT-UHFFFAOYSA-N Synonym: 4-Bromo-1,2-dicyanobenzene PubChem CID: 11356223 IUPAC Name: 4-bromobenzene-1,2-dicarbonitrile SMILES: BrC1=CC(C#N)=C(C=C1)C#N
| PubChem CID | 11356223 |
|---|---|
| CAS | 70484-01-4 |
| Molecular Weight (g/mol) | 207.03 |
| MDL Number | MFCD00221794 |
| SMILES | BrC1=CC(C#N)=C(C=C1)C#N |
| Synonym | 4-Bromo-1,2-dicyanobenzene |
| IUPAC Name | 4-bromobenzene-1,2-dicarbonitrile |
| InChI Key | ARAONWRSVQOHIT-UHFFFAOYSA-N |
| Molecular Formula | C8H3BrN2 |