Benzene and substituted derivatives
Filtered Search Results
2-(5-tert-Butyl-2-hydroxyphenyl)benzotriazole 98.0+%, TCI America™
CAS: 3147-76-0 Molecular Formula: C16H17N3O Molecular Weight (g/mol): 267.332 MDL Number: MFCD03844795 InChI Key: WXHVQMGINBSVAY-UHFFFAOYSA-N PubChem CID: 76605 IUPAC Name: 2-(benzotriazol-2-yl)-4-tert-butylphenol SMILES: CC(C)(C)C1=CC(=C(C=C1)O)N2N=C3C=CC=CC3=N2
| PubChem CID | 76605 |
|---|---|
| CAS | 3147-76-0 |
| Molecular Weight (g/mol) | 267.332 |
| MDL Number | MFCD03844795 |
| SMILES | CC(C)(C)C1=CC(=C(C=C1)O)N2N=C3C=CC=CC3=N2 |
| IUPAC Name | 2-(benzotriazol-2-yl)-4-tert-butylphenol |
| InChI Key | WXHVQMGINBSVAY-UHFFFAOYSA-N |
| Molecular Formula | C16H17N3O |
2-Amino-5-bromobenzonitrile 98.0+%, TCI America™
CAS: 39263-32-6 Molecular Formula: C7H5BrN2 Molecular Weight (g/mol): 197.04 MDL Number: MFCD00158946 InChI Key: OATYCBHROMXWJO-UHFFFAOYSA-N Synonym: 4-bromo-2-cyanoaniline,2-amino-5-brombenzonitrile,2-amio-5-bromobenzonitrile,5-bromoanthranilonitrile,2-amino-5-bromobenzenecarbonitrile,2-amino-5-bromo-benzonitrile,benzonitrile, 2-amino-5-bromo,2-bromo-5-cyanoaniline,pubchem4602,2-cyano-4-bromoaniline PubChem CID: 429740 IUPAC Name: 2-amino-5-bromobenzonitrile SMILES: NC1=CC=C(Br)C=C1C#N
| PubChem CID | 429740 |
|---|---|
| CAS | 39263-32-6 |
| Molecular Weight (g/mol) | 197.04 |
| MDL Number | MFCD00158946 |
| SMILES | NC1=CC=C(Br)C=C1C#N |
| Synonym | 4-bromo-2-cyanoaniline,2-amino-5-brombenzonitrile,2-amio-5-bromobenzonitrile,5-bromoanthranilonitrile,2-amino-5-bromobenzenecarbonitrile,2-amino-5-bromo-benzonitrile,benzonitrile, 2-amino-5-bromo,2-bromo-5-cyanoaniline,pubchem4602,2-cyano-4-bromoaniline |
| IUPAC Name | 2-amino-5-bromobenzonitrile |
| InChI Key | OATYCBHROMXWJO-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrN2 |
(3-Bromophenyl)thiourea 98.0+%, TCI America™
CAS: 21327-14-0 Molecular Formula: C7H7BrN2S Molecular Weight (g/mol): 231.111 MDL Number: MFCD00060440 InChI Key: XBRVSIPVHYWULW-UHFFFAOYSA-N PubChem CID: 2735619 IUPAC Name: (3-bromophenyl)thiourea SMILES: C1=CC(=CC(=C1)Br)NC(=S)N
| PubChem CID | 2735619 |
|---|---|
| CAS | 21327-14-0 |
| Molecular Weight (g/mol) | 231.111 |
| MDL Number | MFCD00060440 |
| SMILES | C1=CC(=CC(=C1)Br)NC(=S)N |
| IUPAC Name | (3-bromophenyl)thiourea |
| InChI Key | XBRVSIPVHYWULW-UHFFFAOYSA-N |
| Molecular Formula | C7H7BrN2S |
4-Hydroxy-4'-methoxybiphenyl 95.0+%, TCI America™
CAS: 16881-71-3 Molecular Formula: C13H12O2 Molecular Weight (g/mol): 200.237 MDL Number: MFCD00191514 InChI Key: CORJIEYQXMZUIW-UHFFFAOYSA-N PubChem CID: 11030839 IUPAC Name: 4-(4-methoxyphenyl)phenol SMILES: COC1=CC=C(C=C1)C2=CC=C(C=C2)O
| PubChem CID | 11030839 |
|---|---|
| CAS | 16881-71-3 |
| Molecular Weight (g/mol) | 200.237 |
| MDL Number | MFCD00191514 |
| SMILES | COC1=CC=C(C=C1)C2=CC=C(C=C2)O |
| IUPAC Name | 4-(4-methoxyphenyl)phenol |
| InChI Key | CORJIEYQXMZUIW-UHFFFAOYSA-N |
| Molecular Formula | C13H12O2 |
(S)-(-)-alpha-Methoxy-alpha-(trifluoromethyl)phenylacetic Acid 98.0+%, TCI America™
CAS: 17257-71-5 Molecular Formula: C10H8F3O3 Molecular Weight (g/mol): 233.17 MDL Number: MFCD00064200 InChI Key: JJYKJUXBWFATTE-VIFPVBQESA-M Synonym: s---alpha-methoxy-alpha-trifluoromethyl phenylacetic acid,s-3,3,3-trifluoro-2-methoxy-2-phenylpropanoic acid,--mosher's acid,--mtpa,unii-172hcj1iqv,172hcj1iqv,2s-3,3,3-trifluoro-2-methoxy-2-phenylpropanoic acid,--alpha-methoxy-alpha-trifluoromethyl phenylacetic acid,s---mtpa,--a-methoxy-a-trifluoromethylphenylacetic acid PubChem CID: 6992788 IUPAC Name: (2S)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoate SMILES: CO[C@](C([O-])=O)(C1=CC=CC=C1)C(F)(F)F
| PubChem CID | 6992788 |
|---|---|
| CAS | 17257-71-5 |
| Molecular Weight (g/mol) | 233.17 |
| MDL Number | MFCD00064200 |
| SMILES | CO[C@](C([O-])=O)(C1=CC=CC=C1)C(F)(F)F |
| Synonym | s---alpha-methoxy-alpha-trifluoromethyl phenylacetic acid,s-3,3,3-trifluoro-2-methoxy-2-phenylpropanoic acid,--mosher's acid,--mtpa,unii-172hcj1iqv,172hcj1iqv,2s-3,3,3-trifluoro-2-methoxy-2-phenylpropanoic acid,--alpha-methoxy-alpha-trifluoromethyl phenylacetic acid,s---mtpa,--a-methoxy-a-trifluoromethylphenylacetic acid |
| IUPAC Name | (2S)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoate |
| InChI Key | JJYKJUXBWFATTE-VIFPVBQESA-M |
| Molecular Formula | C10H8F3O3 |
1,2-Difluorobenzene 98.0+%, TCI America™
CAS: 367-11-3 Molecular Formula: C6H4F2 Molecular Weight (g/mol): 114.10 MDL Number: MFCD00000284 InChI Key: GOYDNIKZWGIXJT-UHFFFAOYSA-N Synonym: o-difluorobenzene,benzene, 1,2-difluoro,benzene, o-difluoro,ortho-difluorobenzene,o-difluoro benzene,difluorobenzene,1,2-difluoro-benzene,unii-aw7qgmw29c,aw7qgmw29c,0-difluorobenzene PubChem CID: 9706 ChEBI: CHEBI:38583 IUPAC Name: 1,2-difluorobenzene SMILES: FC1=CC=CC=C1F
| PubChem CID | 9706 |
|---|---|
| CAS | 367-11-3 |
| Molecular Weight (g/mol) | 114.10 |
| ChEBI | CHEBI:38583 |
| MDL Number | MFCD00000284 |
| SMILES | FC1=CC=CC=C1F |
| Synonym | o-difluorobenzene,benzene, 1,2-difluoro,benzene, o-difluoro,ortho-difluorobenzene,o-difluoro benzene,difluorobenzene,1,2-difluoro-benzene,unii-aw7qgmw29c,aw7qgmw29c,0-difluorobenzene |
| IUPAC Name | 1,2-difluorobenzene |
| InChI Key | GOYDNIKZWGIXJT-UHFFFAOYSA-N |
| Molecular Formula | C6H4F2 |
5-Fluoro-2-nitrobenzotrifluoride 98.0+%, TCI America™
CAS: 393-09-9 Molecular Formula: C7H3F4NO2 Molecular Weight (g/mol): 209.1 MDL Number: MFCD00039741 InChI Key: WMQOSURXFLBTPC-UHFFFAOYSA-N Synonym: 5-fluoro-2-nitrobenzotrifluoride,4-fluoro-1-nitro-2-trifluoromethyl benzene,4-fluoro-2-trifluoromethyl nitrobenzene,2-nitro-alpha,alpha,alpha,5-tetrafluorotoluene,2-nitro-5-fluorobenzotrifluoride,1-fluoro-3-trifluoromethyl-4-nitrobenzene,2-trifluoromethyl-4-fluoronitrobenzene,benzene, 4-fluoro-1-nitro-2-trifluoromethyl,4-fluoro-1-nitro-2-trifluoromethyl-benzene,2-nitro-5-fluorotrifluorotoluol PubChem CID: 223094 IUPAC Name: 4-fluoro-1-nitro-2-(trifluoromethyl)benzene SMILES: C1=CC(=C(C=C1F)C(F)(F)F)[N+](=O)[O-]
| PubChem CID | 223094 |
|---|---|
| CAS | 393-09-9 |
| Molecular Weight (g/mol) | 209.1 |
| MDL Number | MFCD00039741 |
| SMILES | C1=CC(=C(C=C1F)C(F)(F)F)[N+](=O)[O-] |
| Synonym | 5-fluoro-2-nitrobenzotrifluoride,4-fluoro-1-nitro-2-trifluoromethyl benzene,4-fluoro-2-trifluoromethyl nitrobenzene,2-nitro-alpha,alpha,alpha,5-tetrafluorotoluene,2-nitro-5-fluorobenzotrifluoride,1-fluoro-3-trifluoromethyl-4-nitrobenzene,2-trifluoromethyl-4-fluoronitrobenzene,benzene, 4-fluoro-1-nitro-2-trifluoromethyl,4-fluoro-1-nitro-2-trifluoromethyl-benzene,2-nitro-5-fluorotrifluorotoluol |
| IUPAC Name | 4-fluoro-1-nitro-2-(trifluoromethyl)benzene |
| InChI Key | WMQOSURXFLBTPC-UHFFFAOYSA-N |
| Molecular Formula | C7H3F4NO2 |
3-Methoxy-2-methylaniline 98.0+%, TCI America™
CAS: 19500-02-8 Molecular Formula: C8H11NO Molecular Weight (g/mol): 137.18 MDL Number: MFCD06412568 InChI Key: OPXLVWLFDKRYRB-UHFFFAOYSA-N Synonym: 1-Amino-3-methoxy-2-methylbenzene, 3-Methoxy-o-toluidine PubChem CID: 11804822 IUPAC Name: 3-methoxy-2-methylaniline SMILES: COC1=CC=CC(N)=C1C
| PubChem CID | 11804822 |
|---|---|
| CAS | 19500-02-8 |
| Molecular Weight (g/mol) | 137.18 |
| MDL Number | MFCD06412568 |
| SMILES | COC1=CC=CC(N)=C1C |
| Synonym | 1-Amino-3-methoxy-2-methylbenzene, 3-Methoxy-o-toluidine |
| IUPAC Name | 3-methoxy-2-methylaniline |
| InChI Key | OPXLVWLFDKRYRB-UHFFFAOYSA-N |
| Molecular Formula | C8H11NO |
N-Ethylbenzylamine 97.0+%, TCI America™
CAS: 14321-27-8 Molecular Formula: C9H13N Molecular Weight (g/mol): 135.21 MDL Number: MFCD00009031 InChI Key: HVAAHUDGWQAAOJ-UHFFFAOYSA-N Synonym: n-ethylbenzylamine,benzenemethanamine, n-ethyl,ethylbenzylamine,n-benzylethylamine,benzyl ethyl amine,benzylamine, n-ethyl,benzylethylamine,unii-mm8324ke8v,n-benzyl-n-ethylamine,benzyl-ethyl-amine PubChem CID: 84352 IUPAC Name: N-benzylethanamine SMILES: CCNCC1=CC=CC=C1
| PubChem CID | 84352 |
|---|---|
| CAS | 14321-27-8 |
| Molecular Weight (g/mol) | 135.21 |
| MDL Number | MFCD00009031 |
| SMILES | CCNCC1=CC=CC=C1 |
| Synonym | n-ethylbenzylamine,benzenemethanamine, n-ethyl,ethylbenzylamine,n-benzylethylamine,benzyl ethyl amine,benzylamine, n-ethyl,benzylethylamine,unii-mm8324ke8v,n-benzyl-n-ethylamine,benzyl-ethyl-amine |
| IUPAC Name | N-benzylethanamine |
| InChI Key | HVAAHUDGWQAAOJ-UHFFFAOYSA-N |
| Molecular Formula | C9H13N |
2-Cinnamoylthiophene 98.0+%, TCI America™
CAS: 3988-77-0 Molecular Formula: C13H10OS Molecular Weight (g/mol): 214.282 MDL Number: MFCD00059742 InChI Key: DDNPADUKGZMCHV-CMDGGOBGSA-N Synonym: 3-Phenyl-1-(2-thienyl)-2-propen-1-one, Styryl 2-Thienyl Ketone PubChem CID: 5702653 IUPAC Name: (E)-3-phenyl-1-thiophen-2-ylprop-2-en-1-one SMILES: C1=CC=C(C=C1)C=CC(=O)C2=CC=CS2
| PubChem CID | 5702653 |
|---|---|
| CAS | 3988-77-0 |
| Molecular Weight (g/mol) | 214.282 |
| MDL Number | MFCD00059742 |
| SMILES | C1=CC=C(C=C1)C=CC(=O)C2=CC=CS2 |
| Synonym | 3-Phenyl-1-(2-thienyl)-2-propen-1-one, Styryl 2-Thienyl Ketone |
| IUPAC Name | (E)-3-phenyl-1-thiophen-2-ylprop-2-en-1-one |
| InChI Key | DDNPADUKGZMCHV-CMDGGOBGSA-N |
| Molecular Formula | C13H10OS |
4-Chlorobenzyl Bromide 98.0+%, TCI America™
CAS: 622-95-7 Molecular Formula: C7H6BrCl Molecular Weight (g/mol): 205.48 MDL Number: MFCD00040714 InChI Key: KQNBRMUBPRGXSL-UHFFFAOYSA-N Synonym: 4-chlorobenzyl bromide,1-bromomethyl-4-chlorobenzene,p-chlorobenzyl bromide,4-chlorobenzylbromide,benzene, 1-bromomethyl-4-chloro,alpha-bromo-4-chlorotoluene,4cbb,p-chlorobenzylbromide,4-chloro-benzylbromide PubChem CID: 69329 IUPAC Name: 1-(bromomethyl)-4-chlorobenzene SMILES: ClC1=CC=C(CBr)C=C1
| PubChem CID | 69329 |
|---|---|
| CAS | 622-95-7 |
| Molecular Weight (g/mol) | 205.48 |
| MDL Number | MFCD00040714 |
| SMILES | ClC1=CC=C(CBr)C=C1 |
| Synonym | 4-chlorobenzyl bromide,1-bromomethyl-4-chlorobenzene,p-chlorobenzyl bromide,4-chlorobenzylbromide,benzene, 1-bromomethyl-4-chloro,alpha-bromo-4-chlorotoluene,4cbb,p-chlorobenzylbromide,4-chloro-benzylbromide |
| IUPAC Name | 1-(bromomethyl)-4-chlorobenzene |
| InChI Key | KQNBRMUBPRGXSL-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrCl |
Sodium 2,4-Dimethylbenzenesulfonate Monohydrate 98.0+%, TCI America™
CAS: 142063-30-7 Molecular Formula: C8H11NaO4S Molecular Weight (g/mol): 226.222 MDL Number: MFCD00041883 InChI Key: LAOKFSDVOMOLJF-UHFFFAOYSA-M Synonym: 2,4-Dimethylbenzenesulfonic Acid Sodium Salt, Sodium m-Xylene-4-sulfonate, m-Xylene-4-sulfonic Acid Sodium Salt PubChem CID: 70700101 IUPAC Name: sodium;2,4-dimethylbenzenesulfonate;hydrate SMILES: CC1=CC(=C(C=C1)S(=O)(=O)[O-])C.O.[Na+]
| PubChem CID | 70700101 |
|---|---|
| CAS | 142063-30-7 |
| Molecular Weight (g/mol) | 226.222 |
| MDL Number | MFCD00041883 |
| SMILES | CC1=CC(=C(C=C1)S(=O)(=O)[O-])C.O.[Na+] |
| Synonym | 2,4-Dimethylbenzenesulfonic Acid Sodium Salt, Sodium m-Xylene-4-sulfonate, m-Xylene-4-sulfonic Acid Sodium Salt |
| IUPAC Name | sodium;2,4-dimethylbenzenesulfonate;hydrate |
| InChI Key | LAOKFSDVOMOLJF-UHFFFAOYSA-M |
| Molecular Formula | C8H11NaO4S |
2,3-Dimethoxyaniline 98.0+%, TCI America™
CAS: 6299-67-8 Molecular Formula: C8H11NO2 Molecular Weight (g/mol): 153.181 MDL Number: MFCD00180769 InChI Key: HEZIOZBMPKPOER-UHFFFAOYSA-N PubChem CID: 239603 IUPAC Name: 2,3-dimethoxyaniline SMILES: COC1=CC=CC(=C1OC)N
| PubChem CID | 239603 |
|---|---|
| CAS | 6299-67-8 |
| Molecular Weight (g/mol) | 153.181 |
| MDL Number | MFCD00180769 |
| SMILES | COC1=CC=CC(=C1OC)N |
| IUPAC Name | 2,3-dimethoxyaniline |
| InChI Key | HEZIOZBMPKPOER-UHFFFAOYSA-N |
| Molecular Formula | C8H11NO2 |
5-Chloro-2-(methylamino)benzophenone 98.0+%, TCI America™
CAS: 1022-13-5 Molecular Formula: C14H12ClNO Molecular Weight (g/mol): 245.71 MDL Number: MFCD00008284 InChI Key: WPNMLCMTDCANOZ-UHFFFAOYSA-N Synonym: 5-chloro-2-methylamino benzophenone,5-chloro-2-methylaminobenzophenone,2-methylamino-5-chlorobenzophenone,5-chloro-2-methylamino phenyl phenyl methanone,methanone, 5-chloro-2-methylamino phenyl phenyl,unii-d4gd5770pi,benzophenone, 5-chloro-2-methylamino,2-benzoyl-4-chloro-n-methylaniline,5-chloro-2-methylamino phenyl phenylmethanone,5-chloro-2-methylamino phenyl-phenylmethanone PubChem CID: 13925 IUPAC Name: 2-benzoyl-4-chloro-N-methylaniline SMILES: CNC1=CC=C(Cl)C=C1C(=O)C1=CC=CC=C1
| PubChem CID | 13925 |
|---|---|
| CAS | 1022-13-5 |
| Molecular Weight (g/mol) | 245.71 |
| MDL Number | MFCD00008284 |
| SMILES | CNC1=CC=C(Cl)C=C1C(=O)C1=CC=CC=C1 |
| Synonym | 5-chloro-2-methylamino benzophenone,5-chloro-2-methylaminobenzophenone,2-methylamino-5-chlorobenzophenone,5-chloro-2-methylamino phenyl phenyl methanone,methanone, 5-chloro-2-methylamino phenyl phenyl,unii-d4gd5770pi,benzophenone, 5-chloro-2-methylamino,2-benzoyl-4-chloro-n-methylaniline,5-chloro-2-methylamino phenyl phenylmethanone,5-chloro-2-methylamino phenyl-phenylmethanone |
| IUPAC Name | 2-benzoyl-4-chloro-N-methylaniline |
| InChI Key | WPNMLCMTDCANOZ-UHFFFAOYSA-N |
| Molecular Formula | C14H12ClNO |
2-Bromo-5-chlorobenzotrifluoride 98.0+%, TCI America™
CAS: 344-65-0 Molecular Formula: C7H3BrClF3 Molecular Weight (g/mol): 259.45 MDL Number: MFCD00010308 InChI Key: OSTIALFVJOFNPP-UHFFFAOYSA-N Synonym: 2-bromo-5-chlorobenzotrifluoride,1-bromo-4-chloro-2-trifluoromethyl benzene,benzene, 1-bromo-4-chloro-2-trifluoromethyl,2-bromo-5-chorobenzotrifluoride,2-bromo-5-chloro-alpha,alpha,alpha-trifluorotoluene,1-bromo-4-chloro-2-trifluoromethyl-benzene,4-chloro-2-trifluoromethyl bromobenzene,pubchem2713,bromo-5-chlorobenzotrifluoride PubChem CID: 136172 IUPAC Name: 1-bromo-4-chloro-2-(trifluoromethyl)benzene SMILES: C1=CC(=C(C=C1Cl)C(F)(F)F)Br
| PubChem CID | 136172 |
|---|---|
| CAS | 344-65-0 |
| Molecular Weight (g/mol) | 259.45 |
| MDL Number | MFCD00010308 |
| SMILES | C1=CC(=C(C=C1Cl)C(F)(F)F)Br |
| Synonym | 2-bromo-5-chlorobenzotrifluoride,1-bromo-4-chloro-2-trifluoromethyl benzene,benzene, 1-bromo-4-chloro-2-trifluoromethyl,2-bromo-5-chorobenzotrifluoride,2-bromo-5-chloro-alpha,alpha,alpha-trifluorotoluene,1-bromo-4-chloro-2-trifluoromethyl-benzene,4-chloro-2-trifluoromethyl bromobenzene,pubchem2713,bromo-5-chlorobenzotrifluoride |
| IUPAC Name | 1-bromo-4-chloro-2-(trifluoromethyl)benzene |
| InChI Key | OSTIALFVJOFNPP-UHFFFAOYSA-N |
| Molecular Formula | C7H3BrClF3 |