Benzene and substituted derivatives
Filtered Search Results
Ethyl 4-Nitrobenzoate 98.0+%, TCI America™
CAS: 99-77-4 Molecular Formula: C9H9NO4 Molecular Weight (g/mol): 195.174 MDL Number: MFCD00007351 InChI Key: PHWSCBWNPZDYRI-UHFFFAOYSA-N Synonym: ethyl p-nitrobenzoate,benzoic acid, 4-nitro-, ethyl ester,4-nitrobenzoic acid ethyl ester,ethyl nitrobenzoate, para ester,p-nitrobenzoic acid, ethyl ester,4-ethoxycarbonyl nitrobenzene,benzoic acid, p-nitro-, ethyl ester,ethyl-p-nitrobenzoate,unii-1och6y8nar,ethyl para-nitrobenzoate PubChem CID: 7457 IUPAC Name: ethyl 4-nitrobenzoate SMILES: CCOC(=O)C1=CC=C(C=C1)[N+](=O)[O-]
| PubChem CID | 7457 |
|---|---|
| CAS | 99-77-4 |
| Molecular Weight (g/mol) | 195.174 |
| MDL Number | MFCD00007351 |
| SMILES | CCOC(=O)C1=CC=C(C=C1)[N+](=O)[O-] |
| Synonym | ethyl p-nitrobenzoate,benzoic acid, 4-nitro-, ethyl ester,4-nitrobenzoic acid ethyl ester,ethyl nitrobenzoate, para ester,p-nitrobenzoic acid, ethyl ester,4-ethoxycarbonyl nitrobenzene,benzoic acid, p-nitro-, ethyl ester,ethyl-p-nitrobenzoate,unii-1och6y8nar,ethyl para-nitrobenzoate |
| IUPAC Name | ethyl 4-nitrobenzoate |
| InChI Key | PHWSCBWNPZDYRI-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO4 |
(4-Nitrophenyl)thiourea 98.0+%, TCI America™
CAS: 3696-22-8 Molecular Formula: C7H7N3O2S Molecular Weight (g/mol): 197.21 MDL Number: MFCD00007304 InChI Key: BLYAANPIHFKKMQ-UHFFFAOYSA-N Synonym: 1-4-nitrophenyl-2-thiourea,n-4-nitrophenyl thiourea,4-nitrophenyl thiourea,1-4-nitrophenyl thiourea,p-nitrophenyl thiourea,thiourea, 4-nitrophenyl,n-p-nitrophenyl thiourea,acmc-1cny6,4-nitro-phenyl-thiourea,n-4-nitrophenyl thiourea # PubChem CID: 2760234 IUPAC Name: (4-nitrophenyl)thiourea SMILES: NC(=S)NC1=CC=C(C=C1)[N+]([O-])=O
| PubChem CID | 2760234 |
|---|---|
| CAS | 3696-22-8 |
| Molecular Weight (g/mol) | 197.21 |
| MDL Number | MFCD00007304 |
| SMILES | NC(=S)NC1=CC=C(C=C1)[N+]([O-])=O |
| Synonym | 1-4-nitrophenyl-2-thiourea,n-4-nitrophenyl thiourea,4-nitrophenyl thiourea,1-4-nitrophenyl thiourea,p-nitrophenyl thiourea,thiourea, 4-nitrophenyl,n-p-nitrophenyl thiourea,acmc-1cny6,4-nitro-phenyl-thiourea,n-4-nitrophenyl thiourea # |
| IUPAC Name | (4-nitrophenyl)thiourea |
| InChI Key | BLYAANPIHFKKMQ-UHFFFAOYSA-N |
| Molecular Formula | C7H7N3O2S |
2-Methyl-4-nitroaniline 99.0+%, TCI America™
CAS: 99-52-5 Molecular Formula: C7H8N2O2 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00007734 InChI Key: XTTIQGSLJBWVIV-UHFFFAOYSA-N Synonym: 2-amino-5-nitrotoluene,4-nitro-o-toluidine,5-nitro-2-aminotoluene,p-nitro-o-toluidine,benzenamine, 2-methyl-4-nitro,fast red rl base,1-amino-2-methyl-4-nitrobenzene,diabase red rl,ansibases red rl,devol red rl PubChem CID: 7441 IUPAC Name: 2-methyl-4-nitroaniline SMILES: CC1=CC(=CC=C1N)[N+]([O-])=O
| PubChem CID | 7441 |
|---|---|
| CAS | 99-52-5 |
| Molecular Weight (g/mol) | 152.15 |
| MDL Number | MFCD00007734 |
| SMILES | CC1=CC(=CC=C1N)[N+]([O-])=O |
| Synonym | 2-amino-5-nitrotoluene,4-nitro-o-toluidine,5-nitro-2-aminotoluene,p-nitro-o-toluidine,benzenamine, 2-methyl-4-nitro,fast red rl base,1-amino-2-methyl-4-nitrobenzene,diabase red rl,ansibases red rl,devol red rl |
| IUPAC Name | 2-methyl-4-nitroaniline |
| InChI Key | XTTIQGSLJBWVIV-UHFFFAOYSA-N |
| Molecular Formula | C7H8N2O2 |
Bis(3-fluorophenyl) Disulfide 97.0+%, TCI America™
CAS: 63930-17-6 Molecular Formula: C12H8F2S2 Molecular Weight (g/mol): 254.313 MDL Number: MFCD01318104 InChI Key: LFVFHTBHAIVNJQ-UHFFFAOYSA-N Synonym: bis 3-fluorophenyl disulfide,bis 3-fluorophenyl disulphide,1,2-bis 3-fluorophenyl disulfane,3,3'-difluoro diphenyl disulfide,1-fluoro-3-3-fluorophenyl disulfanyl benzene,3,3'-difluorodiphenyl disulfide,bis-3-fluorophenyl disulfide,disulfide, bis 3-fluorophenyl,di3-fluorophenyl disulfide PubChem CID: 2737794 IUPAC Name: 1-fluoro-3-[(3-fluorophenyl)disulfanyl]benzene SMILES: C1=CC(=CC(=C1)SSC2=CC=CC(=C2)F)F
| PubChem CID | 2737794 |
|---|---|
| CAS | 63930-17-6 |
| Molecular Weight (g/mol) | 254.313 |
| MDL Number | MFCD01318104 |
| SMILES | C1=CC(=CC(=C1)SSC2=CC=CC(=C2)F)F |
| Synonym | bis 3-fluorophenyl disulfide,bis 3-fluorophenyl disulphide,1,2-bis 3-fluorophenyl disulfane,3,3'-difluoro diphenyl disulfide,1-fluoro-3-3-fluorophenyl disulfanyl benzene,3,3'-difluorodiphenyl disulfide,bis-3-fluorophenyl disulfide,disulfide, bis 3-fluorophenyl,di3-fluorophenyl disulfide |
| IUPAC Name | 1-fluoro-3-[(3-fluorophenyl)disulfanyl]benzene |
| InChI Key | LFVFHTBHAIVNJQ-UHFFFAOYSA-N |
| Molecular Formula | C12H8F2S2 |
2,3,4-Trifluorophenylboronic Acid (contains varying amounts of Anhydride), TCI America™
CAS: 226396-32-3 Molecular Formula: C6H4BF3O2 Molecular Weight (g/mol): 175.901 MDL Number: MFCD01863168 InChI Key: CLGIPVVEERQWSQ-UHFFFAOYSA-N Synonym: 2,3,4-trifluorophenyl boronic acid,2,3,4-trifluorobenzeneboronic acid,2,3,4-trifluorphenylboronic acid,4,5,6-trifluorophenylboronic acid,boronic acid, 2,3,4-trifluorophenyl,pubchem1887,acmc-1ckzl,trifluorophenylboronic acid,ksc201q5d,jalor-chem i01-8460 PubChem CID: 2783280 IUPAC Name: (2,3,4-trifluorophenyl)boronic acid SMILES: B(C1=C(C(=C(C=C1)F)F)F)(O)O
| PubChem CID | 2783280 |
|---|---|
| CAS | 226396-32-3 |
| Molecular Weight (g/mol) | 175.901 |
| MDL Number | MFCD01863168 |
| SMILES | B(C1=C(C(=C(C=C1)F)F)F)(O)O |
| Synonym | 2,3,4-trifluorophenyl boronic acid,2,3,4-trifluorobenzeneboronic acid,2,3,4-trifluorphenylboronic acid,4,5,6-trifluorophenylboronic acid,boronic acid, 2,3,4-trifluorophenyl,pubchem1887,acmc-1ckzl,trifluorophenylboronic acid,ksc201q5d,jalor-chem i01-8460 |
| IUPAC Name | (2,3,4-trifluorophenyl)boronic acid |
| InChI Key | CLGIPVVEERQWSQ-UHFFFAOYSA-N |
| Molecular Formula | C6H4BF3O2 |
1-Bromo-3-chloro-5-fluorobenzene 98.0+%, TCI America™
CAS: 33863-76-2 Molecular Formula: C6H3BrClF Molecular Weight (g/mol): 209.442 MDL Number: MFCD00070747 InChI Key: GGMDFPMASIXEIR-UHFFFAOYSA-N Synonym: 3-chloro-5-fluorobromobenzene,1-bromo3-chloro-5-fluorobenzene,1-bromo-3-chloro-5-fluoro-benzene,benzene, 1-bromo-3-chloro-5-fluoro,1,3,5-fluorochlorobromobenzene,pubchem2261,acmc-209i3i,ksc494q7t,3-chloro-5-fluoro-bromobenzene,1-bromo-3-chloro-5-flurobenzene PubChem CID: 2736223 IUPAC Name: 1-bromo-3-chloro-5-fluorobenzene SMILES: C1=C(C=C(C=C1Cl)Br)F
| PubChem CID | 2736223 |
|---|---|
| CAS | 33863-76-2 |
| Molecular Weight (g/mol) | 209.442 |
| MDL Number | MFCD00070747 |
| SMILES | C1=C(C=C(C=C1Cl)Br)F |
| Synonym | 3-chloro-5-fluorobromobenzene,1-bromo3-chloro-5-fluorobenzene,1-bromo-3-chloro-5-fluoro-benzene,benzene, 1-bromo-3-chloro-5-fluoro,1,3,5-fluorochlorobromobenzene,pubchem2261,acmc-209i3i,ksc494q7t,3-chloro-5-fluoro-bromobenzene,1-bromo-3-chloro-5-flurobenzene |
| IUPAC Name | 1-bromo-3-chloro-5-fluorobenzene |
| InChI Key | GGMDFPMASIXEIR-UHFFFAOYSA-N |
| Molecular Formula | C6H3BrClF |
1-Ethynyl-2,4-difluorobenzene 96.0+%, TCI America™
CAS: 302912-34-1 Molecular Formula: C8H4F2 Molecular Weight (g/mol): 138.117 MDL Number: MFCD02093726 InChI Key: HRUJQXRGWQWYDH-UHFFFAOYSA-N Synonym: 2,4-Difluorophenylacetylene PubChem CID: 5063820 IUPAC Name: 1-ethynyl-2,4-difluorobenzene SMILES: C#CC1=C(C=C(C=C1)F)F
| PubChem CID | 5063820 |
|---|---|
| CAS | 302912-34-1 |
| Molecular Weight (g/mol) | 138.117 |
| MDL Number | MFCD02093726 |
| SMILES | C#CC1=C(C=C(C=C1)F)F |
| Synonym | 2,4-Difluorophenylacetylene |
| IUPAC Name | 1-ethynyl-2,4-difluorobenzene |
| InChI Key | HRUJQXRGWQWYDH-UHFFFAOYSA-N |
| Molecular Formula | C8H4F2 |
4-Bromofluorobenzene 98.0+%, TCI America™
CAS: 460-00-4 Molecular Formula: C6H4BrF Molecular Weight (g/mol): 175.00 MDL Number: MFCD00000342 InChI Key: AITNMTXHTIIIBB-UHFFFAOYSA-N Synonym: 4-bromofluorobenzene,p-bromofluorobenzene,p-fluorobromobenzene,4-fluorobromobenzene,benzene, 1-bromo-4-fluoro,4-fluorophenyl bromide,1-fluoro-4-bromobenzene,4-fluoro-1-bromobenzene,p-fluorophenyl bromide,bromo fluorobenzene PubChem CID: 9993 IUPAC Name: 1-bromo-4-fluorobenzene SMILES: FC1=CC=C(Br)C=C1
| PubChem CID | 9993 |
|---|---|
| CAS | 460-00-4 |
| Molecular Weight (g/mol) | 175.00 |
| MDL Number | MFCD00000342 |
| SMILES | FC1=CC=C(Br)C=C1 |
| Synonym | 4-bromofluorobenzene,p-bromofluorobenzene,p-fluorobromobenzene,4-fluorobromobenzene,benzene, 1-bromo-4-fluoro,4-fluorophenyl bromide,1-fluoro-4-bromobenzene,4-fluoro-1-bromobenzene,p-fluorophenyl bromide,bromo fluorobenzene |
| IUPAC Name | 1-bromo-4-fluorobenzene |
| InChI Key | AITNMTXHTIIIBB-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrF |
2,3-Difluorophenylacetic Acid 98.0+%, TCI America™
CAS: 145689-41-4 Molecular Formula: C8H6F2O2 Molecular Weight (g/mol): 172.131 MDL Number: MFCD00040968 InChI Key: UXSQXUSJGPVOKT-UHFFFAOYSA-N Synonym: 2,3-difluorophenylacetic acid,2-2,3-difluorophenyl acetic acid,2,3-difluorophenyl acetic acid,2,3-difluorophenylaceticacid,benzeneacetic acid, 2,3-difluoro,2,3-difluorobenzeneacetic acid,rarechem al bo 0630,pubchem1916,acmc-1crot PubChem CID: 520772 IUPAC Name: 2-(2,3-difluorophenyl)acetic acid SMILES: C1=CC(=C(C(=C1)F)F)CC(=O)O
| PubChem CID | 520772 |
|---|---|
| CAS | 145689-41-4 |
| Molecular Weight (g/mol) | 172.131 |
| MDL Number | MFCD00040968 |
| SMILES | C1=CC(=C(C(=C1)F)F)CC(=O)O |
| Synonym | 2,3-difluorophenylacetic acid,2-2,3-difluorophenyl acetic acid,2,3-difluorophenyl acetic acid,2,3-difluorophenylaceticacid,benzeneacetic acid, 2,3-difluoro,2,3-difluorobenzeneacetic acid,rarechem al bo 0630,pubchem1916,acmc-1crot |
| IUPAC Name | 2-(2,3-difluorophenyl)acetic acid |
| InChI Key | UXSQXUSJGPVOKT-UHFFFAOYSA-N |
| Molecular Formula | C8H6F2O2 |
1-Chloro-2,4-difluorobenzene 98.0+%, TCI America™
CAS: 1435-44-5 Molecular Formula: C6H3ClF2 Molecular Weight (g/mol): 148.537 MDL Number: MFCD00042569 InChI Key: AJCSNHQKXUSMMY-UHFFFAOYSA-N Synonym: 2,4-difluorochlorobenzene,1-chloro-2,4-difluoro-benzene,benzene,1-chloro-2,4-difluoro,benzene, 1-chloro-2,4-difluoro,pubchem3415,2,4-difluorchlorbenzol,2,4-diflurochlorobenzene,acmc-1c2st,intermediates-zcf02093,2,4-di-fluorochlorobenzene PubChem CID: 137001 IUPAC Name: 1-chloro-2,4-difluorobenzene SMILES: C1=CC(=C(C=C1F)F)Cl
| PubChem CID | 137001 |
|---|---|
| CAS | 1435-44-5 |
| Molecular Weight (g/mol) | 148.537 |
| MDL Number | MFCD00042569 |
| SMILES | C1=CC(=C(C=C1F)F)Cl |
| Synonym | 2,4-difluorochlorobenzene,1-chloro-2,4-difluoro-benzene,benzene,1-chloro-2,4-difluoro,benzene, 1-chloro-2,4-difluoro,pubchem3415,2,4-difluorchlorbenzol,2,4-diflurochlorobenzene,acmc-1c2st,intermediates-zcf02093,2,4-di-fluorochlorobenzene |
| IUPAC Name | 1-chloro-2,4-difluorobenzene |
| InChI Key | AJCSNHQKXUSMMY-UHFFFAOYSA-N |
| Molecular Formula | C6H3ClF2 |
Neostigmine Bromide 99.0+%, TCI America™
CAS: 114-80-7 Molecular Formula: C12H19BrN2O2 Molecular Weight (g/mol): 303.20 MDL Number: MFCD00011795 InChI Key: LULNWZDBKTWDGK-UHFFFAOYSA-M Synonym: neostigmine bromide,neo-proserin,eustigmin bromide,neoserine bromide,proserine bromide,stigmanol bromide,synstigmin bromide,leostigmine bromide,kirkstigmine bromide,philostigmin bromide PubChem CID: 8246 ChEBI: CHEBI:179557 IUPAC Name: 3-[(dimethylcarbamoyl)oxy]-N,N,N-trimethylanilinium bromide SMILES: [Br-].CN(C)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C
| PubChem CID | 8246 |
|---|---|
| CAS | 114-80-7 |
| Molecular Weight (g/mol) | 303.20 |
| ChEBI | CHEBI:179557 |
| MDL Number | MFCD00011795 |
| SMILES | [Br-].CN(C)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C |
| Synonym | neostigmine bromide,neo-proserin,eustigmin bromide,neoserine bromide,proserine bromide,stigmanol bromide,synstigmin bromide,leostigmine bromide,kirkstigmine bromide,philostigmin bromide |
| IUPAC Name | 3-[(dimethylcarbamoyl)oxy]-N,N,N-trimethylanilinium bromide |
| InChI Key | LULNWZDBKTWDGK-UHFFFAOYSA-M |
| Molecular Formula | C12H19BrN2O2 |
2-Amino-3,4-dimethylbenzoic Acid 98.0+%, TCI America™
CAS: 50419-58-4 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.19 MDL Number: MFCD00130041 InChI Key: MUOBMUYSNYMSDM-UHFFFAOYSA-N Synonym: 2-amino-3,4-dimethyl-benzoic acid,3,4-dimethylanthranilic acid,benzoic acid, 2-amino-3,4-dimethyl,pubchem4683,acmc-1aomr,ksc272a3h,2-amino-3,4-dimethyl benzoic acid PubChem CID: 282450 IUPAC Name: 2-amino-3,4-dimethylbenzoic acid SMILES: CC1=CC=C(C(O)=O)C(N)=C1C
| PubChem CID | 282450 |
|---|---|
| CAS | 50419-58-4 |
| Molecular Weight (g/mol) | 165.19 |
| MDL Number | MFCD00130041 |
| SMILES | CC1=CC=C(C(O)=O)C(N)=C1C |
| Synonym | 2-amino-3,4-dimethyl-benzoic acid,3,4-dimethylanthranilic acid,benzoic acid, 2-amino-3,4-dimethyl,pubchem4683,acmc-1aomr,ksc272a3h,2-amino-3,4-dimethyl benzoic acid |
| IUPAC Name | 2-amino-3,4-dimethylbenzoic acid |
| InChI Key | MUOBMUYSNYMSDM-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO2 |
5-Amino-2-methylbenzoic Acid 98.0+%, TCI America™
CAS: 2840-04-2 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.17 MDL Number: MFCD06208351 InChI Key: FSXVZWAWYKMFMX-UHFFFAOYSA-N Synonym: 5-amino-2-methyl-benzoic acid,5-amino-2-methyl benzoic acid,2-methyl-5-aminobenzoic acid,5-amino-o-toluic acid,5-amino-2-methylbenzoicacid,benzoic acid, 5-amino-2-methyl,pubchem4980,3-amino-6-methylbenzoic acid,ksc494q3t,2-methyl-5-amino benzoic acid PubChem CID: 10374614 IUPAC Name: 5-amino-2-methylbenzoic acid SMILES: CC1=C(C=C(C=C1)N)C(=O)O
| PubChem CID | 10374614 |
|---|---|
| CAS | 2840-04-2 |
| Molecular Weight (g/mol) | 151.17 |
| MDL Number | MFCD06208351 |
| SMILES | CC1=C(C=C(C=C1)N)C(=O)O |
| Synonym | 5-amino-2-methyl-benzoic acid,5-amino-2-methyl benzoic acid,2-methyl-5-aminobenzoic acid,5-amino-o-toluic acid,5-amino-2-methylbenzoicacid,benzoic acid, 5-amino-2-methyl,pubchem4980,3-amino-6-methylbenzoic acid,ksc494q3t,2-methyl-5-amino benzoic acid |
| IUPAC Name | 5-amino-2-methylbenzoic acid |
| InChI Key | FSXVZWAWYKMFMX-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO2 |
4-Dimethylaminobenzoic Acid 98.0+%, TCI America™
CAS: 619-84-1 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.192 MDL Number: MFCD00002537 InChI Key: YDIYEOMDOWUDTJ-UHFFFAOYSA-N Synonym: 4-dimethylamino benzoic acid,benzoic acid, 4-dimethylamino,benzoic acid, p-dimethylamino,p-dimethylaminobenzoic acid,n,n-dimethyl-p-aminobenzoic acid,n,n-dimethyl-4-aminobenzoic acid,p-n,n-dimethylamino benzoic acid,p-dimethylamino benzoic acid,unii-d1ma908ev0,4-n,n-dimethylamino benzoic acid PubChem CID: 12092 IUPAC Name: 4-(dimethylamino)benzoic acid SMILES: CN(C)C1=CC=C(C=C1)C(=O)O
| PubChem CID | 12092 |
|---|---|
| CAS | 619-84-1 |
| Molecular Weight (g/mol) | 165.192 |
| MDL Number | MFCD00002537 |
| SMILES | CN(C)C1=CC=C(C=C1)C(=O)O |
| Synonym | 4-dimethylamino benzoic acid,benzoic acid, 4-dimethylamino,benzoic acid, p-dimethylamino,p-dimethylaminobenzoic acid,n,n-dimethyl-p-aminobenzoic acid,n,n-dimethyl-4-aminobenzoic acid,p-n,n-dimethylamino benzoic acid,p-dimethylamino benzoic acid,unii-d1ma908ev0,4-n,n-dimethylamino benzoic acid |
| IUPAC Name | 4-(dimethylamino)benzoic acid |
| InChI Key | YDIYEOMDOWUDTJ-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO2 |