Benzene and substituted derivatives
Filtered Search Results
4-(tert-Butoxycarbonylamino)benzoic Acid 98.0+%, TCI America™
CAS: 66493-39-8 Molecular Formula: C12H15NO4 Molecular Weight (g/mol): 237.255 MDL Number: MFCD00037428 InChI Key: ZJDBQMWMDZEONW-UHFFFAOYSA-N Synonym: boc-4-abz-oh,4-boc-amino benzoic acid,4-tert-butoxycarbonyl amino benzoic acid,4-tert-butoxycarbonylamino-benzoic acid,n-boc-4-aminobenzoic acid,4-tert-butoxycarbonylaminobenzoic acid,4-tert-butoxycarbonylamino benzoic acid,boc-p-aminobenzoic acid,4-boc-amino-benzoic acid PubChem CID: 2755931 IUPAC Name: 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid SMILES: CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)O
| PubChem CID | 2755931 |
|---|---|
| CAS | 66493-39-8 |
| Molecular Weight (g/mol) | 237.255 |
| MDL Number | MFCD00037428 |
| SMILES | CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)O |
| Synonym | boc-4-abz-oh,4-boc-amino benzoic acid,4-tert-butoxycarbonyl amino benzoic acid,4-tert-butoxycarbonylamino-benzoic acid,n-boc-4-aminobenzoic acid,4-tert-butoxycarbonylaminobenzoic acid,4-tert-butoxycarbonylamino benzoic acid,boc-p-aminobenzoic acid,4-boc-amino-benzoic acid |
| IUPAC Name | 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid |
| InChI Key | ZJDBQMWMDZEONW-UHFFFAOYSA-N |
| Molecular Formula | C12H15NO4 |
1,8-Bis(diphenylphosphino)naphthalene 97.0+%, TCI America™
CAS: 153725-04-3 Molecular Formula: C34H26P2 Molecular Weight (g/mol): 496.53 MDL Number: MFCD04117326 InChI Key: QOXZKPURCFVBRR-UHFFFAOYSA-N PubChem CID: 2756729 IUPAC Name: [8-(diphenylphosphanyl)naphthalen-1-yl]diphenylphosphane SMILES: C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC2=CC=CC(P(C3=CC=CC=C3)C3=CC=CC=C3)=C12
| PubChem CID | 2756729 |
|---|---|
| CAS | 153725-04-3 |
| Molecular Weight (g/mol) | 496.53 |
| MDL Number | MFCD04117326 |
| SMILES | C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC2=CC=CC(P(C3=CC=CC=C3)C3=CC=CC=C3)=C12 |
| IUPAC Name | [8-(diphenylphosphanyl)naphthalen-1-yl]diphenylphosphane |
| InChI Key | QOXZKPURCFVBRR-UHFFFAOYSA-N |
| Molecular Formula | C34H26P2 |
6-Amino-5-bromoquinoxaline 98.0+%, TCI America™
CAS: 50358-63-9 Molecular Formula: C8H6BrN3 Molecular Weight (g/mol): 224.06 MDL Number: MFCD00799024 InChI Key: IRAOSCSPAYZRJE-UHFFFAOYSA-N PubChem CID: 14928442 IUPAC Name: 5-bromoquinoxalin-6-amine SMILES: NC1=CC=C2N=CC=NC2=C1Br
| PubChem CID | 14928442 |
|---|---|
| CAS | 50358-63-9 |
| Molecular Weight (g/mol) | 224.06 |
| MDL Number | MFCD00799024 |
| SMILES | NC1=CC=C2N=CC=NC2=C1Br |
| IUPAC Name | 5-bromoquinoxalin-6-amine |
| InChI Key | IRAOSCSPAYZRJE-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrN3 |
2,4,5-Trifluoro-1,3-phenylenediamine 98.0+%, TCI America™
CAS: 321182-37-0 Molecular Formula: C6H5F3N2 Molecular Weight (g/mol): 162.115 MDL Number: MFCD04114298 InChI Key: ONVSXVVJFJJZQX-UHFFFAOYSA-N Synonym: 1,3-Diamino-2,4,5-trifluorobenzene PubChem CID: 15531223 IUPAC Name: 2,4,5-trifluorobenzene-1,3-diamine SMILES: C1=C(C(=C(C(=C1F)F)N)F)N
| PubChem CID | 15531223 |
|---|---|
| CAS | 321182-37-0 |
| Molecular Weight (g/mol) | 162.115 |
| MDL Number | MFCD04114298 |
| SMILES | C1=C(C(=C(C(=C1F)F)N)F)N |
| Synonym | 1,3-Diamino-2,4,5-trifluorobenzene |
| IUPAC Name | 2,4,5-trifluorobenzene-1,3-diamine |
| InChI Key | ONVSXVVJFJJZQX-UHFFFAOYSA-N |
| Molecular Formula | C6H5F3N2 |
2-Fluorobenzyl Cyanide 97.0+%, TCI America™
CAS: 326-62-5 Molecular Formula: C8H6FN Molecular Weight (g/mol): 135.14 MDL Number: MFCD00001897 InChI Key: DAVJMKMVLKOQQC-UHFFFAOYSA-N Synonym: 2-fluorophenylacetonitrile,2-fluorobenzyl cyanide,2-2-fluorophenyl acetonitrile,benzeneacetonitrile, 2-fluoro,o-fluorophenylacetonitrile,o-fluorobenzyl cyanide,2-fluorophenyl acetonitrile,acetonitrile, o-fluorophenyl,2-2-fluorophenyl ethanenitrile,2-fluorobenzeneacetonitrile PubChem CID: 67592 IUPAC Name: 2-(2-fluorophenyl)acetonitrile SMILES: FC1=CC=CC=C1CC#N
| PubChem CID | 67592 |
|---|---|
| CAS | 326-62-5 |
| Molecular Weight (g/mol) | 135.14 |
| MDL Number | MFCD00001897 |
| SMILES | FC1=CC=CC=C1CC#N |
| Synonym | 2-fluorophenylacetonitrile,2-fluorobenzyl cyanide,2-2-fluorophenyl acetonitrile,benzeneacetonitrile, 2-fluoro,o-fluorophenylacetonitrile,o-fluorobenzyl cyanide,2-fluorophenyl acetonitrile,acetonitrile, o-fluorophenyl,2-2-fluorophenyl ethanenitrile,2-fluorobenzeneacetonitrile |
| IUPAC Name | 2-(2-fluorophenyl)acetonitrile |
| InChI Key | DAVJMKMVLKOQQC-UHFFFAOYSA-N |
| Molecular Formula | C8H6FN |
Methyl 2-(Trifluoromethyl)benzoate 98.0+%, TCI America™
CAS: 344-96-7 Molecular Formula: C9H7F3O2 Molecular Weight (g/mol): 204.148 MDL Number: MFCD00236050 InChI Key: JLCAMDSWNZBTEE-UHFFFAOYSA-N Synonym: methyl 2-trifluoromethyl benzoate,benzoic acid, trifluoromethyl-, methyl ester,acmc-1ahfp,methyl o-trifluoromethylbenzoate,jlcamdswnzbtee-uhfffaoysa,methyl-2-trifluoromethyl benzoate,2-trifluoromethylbenzoic acid methyl ester,2-trifluoromethyl-benzoic acid methyl ester,2-trifluoromethyl benzoic acid methyl ester,methyl alpha,alpha,alpha-trifluoro-o-toluate PubChem CID: 2775578 IUPAC Name: methyl 2-(trifluoromethyl)benzoate SMILES: COC(=O)C1=CC=CC=C1C(F)(F)F
| PubChem CID | 2775578 |
|---|---|
| CAS | 344-96-7 |
| Molecular Weight (g/mol) | 204.148 |
| MDL Number | MFCD00236050 |
| SMILES | COC(=O)C1=CC=CC=C1C(F)(F)F |
| Synonym | methyl 2-trifluoromethyl benzoate,benzoic acid, trifluoromethyl-, methyl ester,acmc-1ahfp,methyl o-trifluoromethylbenzoate,jlcamdswnzbtee-uhfffaoysa,methyl-2-trifluoromethyl benzoate,2-trifluoromethylbenzoic acid methyl ester,2-trifluoromethyl-benzoic acid methyl ester,2-trifluoromethyl benzoic acid methyl ester,methyl alpha,alpha,alpha-trifluoro-o-toluate |
| IUPAC Name | methyl 2-(trifluoromethyl)benzoate |
| InChI Key | JLCAMDSWNZBTEE-UHFFFAOYSA-N |
| Molecular Formula | C9H7F3O2 |
Pentabromobenzyl Alcohol 98.0+%, TCI America™
CAS: 79415-41-1 Molecular Formula: C7H3Br5O Molecular Weight (g/mol): 502.62 MDL Number: MFCD00192377 InChI Key: KKWHDMUCBWSKGL-UHFFFAOYSA-N Synonym: 2,3,4,5,6-pentabromobenzyl alcohol,pentabromobenzyl alcohol,2,3,4,5,6-pentabromophenyl methanol,acmc-1beji,2,3,4,5,6-pentabromobenzylalcohol,kkwhdmucbwskgl-uhfffaoysa,benzenemethanol,2,3,4,5,6-pentabromo PubChem CID: 2733946 IUPAC Name: (2,3,4,5,6-pentabromophenyl)methanol SMILES: C(C1=C(C(=C(C(=C1Br)Br)Br)Br)Br)O
| PubChem CID | 2733946 |
|---|---|
| CAS | 79415-41-1 |
| Molecular Weight (g/mol) | 502.62 |
| MDL Number | MFCD00192377 |
| SMILES | C(C1=C(C(=C(C(=C1Br)Br)Br)Br)Br)O |
| Synonym | 2,3,4,5,6-pentabromobenzyl alcohol,pentabromobenzyl alcohol,2,3,4,5,6-pentabromophenyl methanol,acmc-1beji,2,3,4,5,6-pentabromobenzylalcohol,kkwhdmucbwskgl-uhfffaoysa,benzenemethanol,2,3,4,5,6-pentabromo |
| IUPAC Name | (2,3,4,5,6-pentabromophenyl)methanol |
| InChI Key | KKWHDMUCBWSKGL-UHFFFAOYSA-N |
| Molecular Formula | C7H3Br5O |
Dimethyl 5-Bromoisophthalate 98.0+%, TCI America™
CAS: 51760-21-5 Molecular Formula: C10H9BrO4 Molecular Weight (g/mol): 273.082 MDL Number: MFCD00078709 InChI Key: QUJINGKSNJNXEB-UHFFFAOYSA-N PubChem CID: 103954 IUPAC Name: dimethyl 5-bromobenzene-1,3-dicarboxylate SMILES: COC(=O)C1=CC(=CC(=C1)Br)C(=O)OC
| PubChem CID | 103954 |
|---|---|
| CAS | 51760-21-5 |
| Molecular Weight (g/mol) | 273.082 |
| MDL Number | MFCD00078709 |
| SMILES | COC(=O)C1=CC(=CC(=C1)Br)C(=O)OC |
| IUPAC Name | dimethyl 5-bromobenzene-1,3-dicarboxylate |
| InChI Key | QUJINGKSNJNXEB-UHFFFAOYSA-N |
| Molecular Formula | C10H9BrO4 |
trans,trans-4-(3,4-Difluorophenyl)-4'-vinylbicyclohexyl 98.0+%, TCI America™
CAS: 142400-92-8 Molecular Formula: C20H26F2 Molecular Weight (g/mol): 304.425 MDL Number: MFCD09842838 InChI Key: ALFLDQIYGBNZCO-UHFFFAOYSA-N Synonym: trans,trans-4-3,4-difluorophenyl-4'-vinyl-1,1'-bi cyclohexane,trans,trans-4-3,4-difluorophenyl-4'-vinylbicyclohexyl,trans-4-3,4-difluorophenyl-trans-4'-vinylbicyclohexane,benzene, 4-trans,trans-4'-ethenyl 1,1'-bicyclohexyl-4-yl-1,2-difluoro,trans trans-4-4'-ethenyl 1,1'-bicyclohexyl-4-yl-1,2-difluorobenzene,trans,trans-4-3,4-difluoro-phenyl-4'-vinyl-bicyclohexyl,4-3,4-difluorophenyl-4'-vinylbi cyclohexane,4-e-1,2-dicyclohexylethenyl-1,2-difluorobenzene,4-vinyl-4'-3,4-difluorophenyl-1,1'-bicyclohexane,trans-4-3,4-difluorophenyl-trans-4-vinylbicyclohexane PubChem CID: 12010662 IUPAC Name: 4-[4-(4-ethenylcyclohexyl)cyclohexyl]-1,2-difluorobenzene SMILES: C=CC1CCC(CC1)C2CCC(CC2)C3=CC(=C(C=C3)F)F
| PubChem CID | 12010662 |
|---|---|
| CAS | 142400-92-8 |
| Molecular Weight (g/mol) | 304.425 |
| MDL Number | MFCD09842838 |
| SMILES | C=CC1CCC(CC1)C2CCC(CC2)C3=CC(=C(C=C3)F)F |
| Synonym | trans,trans-4-3,4-difluorophenyl-4'-vinyl-1,1'-bi cyclohexane,trans,trans-4-3,4-difluorophenyl-4'-vinylbicyclohexyl,trans-4-3,4-difluorophenyl-trans-4'-vinylbicyclohexane,benzene, 4-trans,trans-4'-ethenyl 1,1'-bicyclohexyl-4-yl-1,2-difluoro,trans trans-4-4'-ethenyl 1,1'-bicyclohexyl-4-yl-1,2-difluorobenzene,trans,trans-4-3,4-difluoro-phenyl-4'-vinyl-bicyclohexyl,4-3,4-difluorophenyl-4'-vinylbi cyclohexane,4-e-1,2-dicyclohexylethenyl-1,2-difluorobenzene,4-vinyl-4'-3,4-difluorophenyl-1,1'-bicyclohexane,trans-4-3,4-difluorophenyl-trans-4-vinylbicyclohexane |
| IUPAC Name | 4-[4-(4-ethenylcyclohexyl)cyclohexyl]-1,2-difluorobenzene |
| InChI Key | ALFLDQIYGBNZCO-UHFFFAOYSA-N |
| Molecular Formula | C20H26F2 |
Ethylene Glycol Mono(4-bromophenyl) Ether 98.0+%, TCI America™
CAS: 34743-88-9 Molecular Formula: C8H9BrO2 Molecular Weight (g/mol): 217.06 MDL Number: MFCD00002860 InChI Key: QYIOGYCRGNHDNK-UHFFFAOYSA-N Synonym: 2-(4-Bromophenoxy)ethanol PubChem CID: 99168 IUPAC Name: 2-(4-bromophenoxy)ethan-1-ol SMILES: OCCOC1=CC=C(Br)C=C1
| PubChem CID | 99168 |
|---|---|
| CAS | 34743-88-9 |
| Molecular Weight (g/mol) | 217.06 |
| MDL Number | MFCD00002860 |
| SMILES | OCCOC1=CC=C(Br)C=C1 |
| Synonym | 2-(4-Bromophenoxy)ethanol |
| IUPAC Name | 2-(4-bromophenoxy)ethan-1-ol |
| InChI Key | QYIOGYCRGNHDNK-UHFFFAOYSA-N |
| Molecular Formula | C8H9BrO2 |
2-Aminobenzotrifluoride 98.0+%, TCI America™
CAS: 88-17-5 Molecular Formula: C7H6F3N Molecular Weight (g/mol): 161.127 MDL Number: MFCD00007718 InChI Key: VBLXCTYLWZJBKA-UHFFFAOYSA-N Synonym: 2-trifluoromethyl aniline,2-aminobenzotrifluoride,o-aminobenzotrifluoride,o-trifluoromethyl aniline,o-trifluoromethylaniline,benzenamine, 2-trifluoromethyl,2-trifluoromethyl benzenamine,alpha,alpha,alpha-trifluoro-o-toluidine,2-aminotrifluorotoluene,2-aminotrifluoromethylbenzene PubChem CID: 6922 IUPAC Name: 2-(trifluoromethyl)aniline SMILES: C1=CC=C(C(=C1)C(F)(F)F)N
| PubChem CID | 6922 |
|---|---|
| CAS | 88-17-5 |
| Molecular Weight (g/mol) | 161.127 |
| MDL Number | MFCD00007718 |
| SMILES | C1=CC=C(C(=C1)C(F)(F)F)N |
| Synonym | 2-trifluoromethyl aniline,2-aminobenzotrifluoride,o-aminobenzotrifluoride,o-trifluoromethyl aniline,o-trifluoromethylaniline,benzenamine, 2-trifluoromethyl,2-trifluoromethyl benzenamine,alpha,alpha,alpha-trifluoro-o-toluidine,2-aminotrifluorotoluene,2-aminotrifluoromethylbenzene |
| IUPAC Name | 2-(trifluoromethyl)aniline |
| InChI Key | VBLXCTYLWZJBKA-UHFFFAOYSA-N |
| Molecular Formula | C7H6F3N |
4-Nitrostyrene (stabilized with TBC) 98.0+%, TCI America™
CAS: 100-13-0 Molecular Formula: C8H7NO2 Molecular Weight (g/mol): 149.15 MDL Number: MFCD00041254 InChI Key: YFZHODLXYNDBSM-UHFFFAOYSA-N Synonym: 4-nitrostyrene,1-nitro-4-vinylbenzene,p-nitrostyrene,benzene, 1-ethenyl-4-nitro,ccris 1674,styrene, p-nitro,benzene, 1-ethenyl-4-nitro-9ci,nitrovinylbenzene,4-nitro-styrene,p-nitrophenylethylene PubChem CID: 7481 IUPAC Name: 1-ethenyl-4-nitrobenzene SMILES: [O-][N+](=O)C1=CC=C(C=C)C=C1
| PubChem CID | 7481 |
|---|---|
| CAS | 100-13-0 |
| Molecular Weight (g/mol) | 149.15 |
| MDL Number | MFCD00041254 |
| SMILES | [O-][N+](=O)C1=CC=C(C=C)C=C1 |
| Synonym | 4-nitrostyrene,1-nitro-4-vinylbenzene,p-nitrostyrene,benzene, 1-ethenyl-4-nitro,ccris 1674,styrene, p-nitro,benzene, 1-ethenyl-4-nitro-9ci,nitrovinylbenzene,4-nitro-styrene,p-nitrophenylethylene |
| IUPAC Name | 1-ethenyl-4-nitrobenzene |
| InChI Key | YFZHODLXYNDBSM-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO2 |
2-Chloro-6-fluorobenzaldehyde 95.0+%, TCI America™
CAS: 387-45-1 Molecular Formula: C7H4ClFO Molecular Weight (g/mol): 158.56 MDL Number: MFCD00003306 InChI Key: OACPOWYLLGHGCR-UHFFFAOYSA-N Synonym: benzaldehyde, 2-chloro-6-fluoro,2,6-cfad,2-chloro-6-fluoro-benzaldehyd,unii-51yj9bw8w7,2-chloro-6-fluoro benzaldehyde,2-chloro-6-fluoro-benzaldehyde,2-fluoro-6-chloro benzaldehyde,6-chloro-2-fluorobenzaldehyde,pubchem1434,acmc-209j1r PubChem CID: 67847 IUPAC Name: 2-chloro-6-fluorobenzaldehyde SMILES: FC1=CC=CC(Cl)=C1C=O
| PubChem CID | 67847 |
|---|---|
| CAS | 387-45-1 |
| Molecular Weight (g/mol) | 158.56 |
| MDL Number | MFCD00003306 |
| SMILES | FC1=CC=CC(Cl)=C1C=O |
| Synonym | benzaldehyde, 2-chloro-6-fluoro,2,6-cfad,2-chloro-6-fluoro-benzaldehyd,unii-51yj9bw8w7,2-chloro-6-fluoro benzaldehyde,2-chloro-6-fluoro-benzaldehyde,2-fluoro-6-chloro benzaldehyde,6-chloro-2-fluorobenzaldehyde,pubchem1434,acmc-209j1r |
| IUPAC Name | 2-chloro-6-fluorobenzaldehyde |
| InChI Key | OACPOWYLLGHGCR-UHFFFAOYSA-N |
| Molecular Formula | C7H4ClFO |
5-Hydroxy-2-nitrobenzaldehyde 98.0+%, TCI America™
CAS: 42454-06-8 Molecular Formula: C7H5NO4 Molecular Weight (g/mol): 167.12 MDL Number: MFCD00007332 InChI Key: XLYPHUGUKGMURE-UHFFFAOYSA-N Synonym: 3-formyl-4-nitrophenol,6-nitro-3-hydroxybenzaldehyde,2-nitro-5-hydroxybenzaldehyde,5-hydroxy-2-nitro-benzaldehyde,benzaldehyde, 5-hydroxy-2-nitro,unii-va926z93if,6-nitro-3-hydroxy benzaldhyde,pubchem8205,acmc-1an3l,4-08-00-00250 beilstein handbook reference PubChem CID: 39211 IUPAC Name: 5-hydroxy-2-nitrobenzaldehyde SMILES: OC1=CC=C(C(C=O)=C1)[N+]([O-])=O
| PubChem CID | 39211 |
|---|---|
| CAS | 42454-06-8 |
| Molecular Weight (g/mol) | 167.12 |
| MDL Number | MFCD00007332 |
| SMILES | OC1=CC=C(C(C=O)=C1)[N+]([O-])=O |
| Synonym | 3-formyl-4-nitrophenol,6-nitro-3-hydroxybenzaldehyde,2-nitro-5-hydroxybenzaldehyde,5-hydroxy-2-nitro-benzaldehyde,benzaldehyde, 5-hydroxy-2-nitro,unii-va926z93if,6-nitro-3-hydroxy benzaldhyde,pubchem8205,acmc-1an3l,4-08-00-00250 beilstein handbook reference |
| IUPAC Name | 5-hydroxy-2-nitrobenzaldehyde |
| InChI Key | XLYPHUGUKGMURE-UHFFFAOYSA-N |
| Molecular Formula | C7H5NO4 |
3-Chlorobenzoic Acid 99.0+%, TCI America™
CAS: 535-80-8 Molecular Formula: C7H5ClO2 Molecular Weight (g/mol): 156.565 MDL Number: MFCD00002491 InChI Key: LULAYUGMBFYYEX-UHFFFAOYSA-N Synonym: m-chlorobenzoic acid,benzoic acid, 3-chloro,benzoic acid, m-chloro,3-chlorobenzoicacid,3-chloro-benzoic acid,m-chlorobenzoate,acido m-clorobenzoico,unii-02uoj7064k,mcba,ccris 5992 PubChem CID: 447 ChEBI: CHEBI:49410 IUPAC Name: 3-chlorobenzoic acid SMILES: C1=CC(=CC(=C1)Cl)C(=O)O
| PubChem CID | 447 |
|---|---|
| CAS | 535-80-8 |
| Molecular Weight (g/mol) | 156.565 |
| ChEBI | CHEBI:49410 |
| MDL Number | MFCD00002491 |
| SMILES | C1=CC(=CC(=C1)Cl)C(=O)O |
| Synonym | m-chlorobenzoic acid,benzoic acid, 3-chloro,benzoic acid, m-chloro,3-chlorobenzoicacid,3-chloro-benzoic acid,m-chlorobenzoate,acido m-clorobenzoico,unii-02uoj7064k,mcba,ccris 5992 |
| IUPAC Name | 3-chlorobenzoic acid |
| InChI Key | LULAYUGMBFYYEX-UHFFFAOYSA-N |
| Molecular Formula | C7H5ClO2 |