Benzene and substituted derivatives
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Phenylhydrazine Hydrochloride 98.5+%, TCI America™
CAS: 59-88-1 Molecular Formula: C6H9ClN2 Molecular Weight (g/mol): 144.60 MDL Number: MFCD00012924 InChI Key: JOVOSQBPPZZESK-UHFFFAOYSA-N Synonym: phenylhydrazine hydrochloride,phenylhydrazinium chloride,phenylhydrazine-hcl,phenylhydrazine monohydrochloride,phenylhydrazine hcl,hydrazine, phenyl-, monohydrochloride,unii-h7qfk49svd,phenylhydrazin hydrochlorid,phenylhydrazine.hcl,ccris 5707 PubChem CID: 60962 IUPAC Name: hydrogen phenylhydrazine chloride SMILES: [H+].[Cl-].NNC1=CC=CC=C1
| PubChem CID | 60962 |
|---|---|
| CAS | 59-88-1 |
| Molecular Weight (g/mol) | 144.60 |
| MDL Number | MFCD00012924 |
| SMILES | [H+].[Cl-].NNC1=CC=CC=C1 |
| Synonym | phenylhydrazine hydrochloride,phenylhydrazinium chloride,phenylhydrazine-hcl,phenylhydrazine monohydrochloride,phenylhydrazine hcl,hydrazine, phenyl-, monohydrochloride,unii-h7qfk49svd,phenylhydrazin hydrochlorid,phenylhydrazine.hcl,ccris 5707 |
| IUPAC Name | hydrogen phenylhydrazine chloride |
| InChI Key | JOVOSQBPPZZESK-UHFFFAOYSA-N |
| Molecular Formula | C6H9ClN2 |
Benzyl 2-Bromoethyl Ether 97.0+%, TCI America™
CAS: 1462-37-9 Molecular Formula: C9H11BrO Molecular Weight (g/mol): 215.09 MDL Number: MFCD01321307 InChI Key: FWOHDAGPWDEWIB-UHFFFAOYSA-N Synonym: benzyl 2-bromoethyl ether,2-bromoethoxy methyl benzene,2-benzyloxy-1-bromoethane,benzyloxyethyl bromide,benzene, 2-bromoethoxy methyl,1-bromo-2-benzyloxyethane,2-bromoethoxymethyl benzene,2-bromo-ethoxymethyl-benzene PubChem CID: 73833 IUPAC Name: 2-bromoethoxymethylbenzene SMILES: C1=CC=C(C=C1)COCCBr
| PubChem CID | 73833 |
|---|---|
| CAS | 1462-37-9 |
| Molecular Weight (g/mol) | 215.09 |
| MDL Number | MFCD01321307 |
| SMILES | C1=CC=C(C=C1)COCCBr |
| Synonym | benzyl 2-bromoethyl ether,2-bromoethoxy methyl benzene,2-benzyloxy-1-bromoethane,benzyloxyethyl bromide,benzene, 2-bromoethoxy methyl,1-bromo-2-benzyloxyethane,2-bromoethoxymethyl benzene,2-bromo-ethoxymethyl-benzene |
| IUPAC Name | 2-bromoethoxymethylbenzene |
| InChI Key | FWOHDAGPWDEWIB-UHFFFAOYSA-N |
| Molecular Formula | C9H11BrO |
2-Bromo-4-methoxyphenylacetic Acid 98.0+%, TCI America™
CAS: 66916-99-2 Molecular Formula: C9H9BrO3 Molecular Weight (g/mol): 245.07 MDL Number: MFCD02664700 InChI Key: XQELSBAAFMYSMG-UHFFFAOYSA-N PubChem CID: 3963668 IUPAC Name: 2-(2-bromo-4-methoxyphenyl)acetic acid SMILES: COC1=CC(Br)=C(CC(O)=O)C=C1
| PubChem CID | 3963668 |
|---|---|
| CAS | 66916-99-2 |
| Molecular Weight (g/mol) | 245.07 |
| MDL Number | MFCD02664700 |
| SMILES | COC1=CC(Br)=C(CC(O)=O)C=C1 |
| IUPAC Name | 2-(2-bromo-4-methoxyphenyl)acetic acid |
| InChI Key | XQELSBAAFMYSMG-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO3 |
3-Fluorobenzenesulfonamide 98.0+%, TCI America™
CAS: 1524-40-9 Molecular Formula: C6H6FNO2S Molecular Weight (g/mol): 175.177 MDL Number: MFCD00042284 InChI Key: CRINBBOGNYCAOV-UHFFFAOYSA-N Synonym: 3-fluorobenzene-1-sulfonamide,benzenesulfonamide, 3-fluoro,3-fluorobenzenesulphonamide,3-fbsa,2weo,pubchem11762,acmc-20a5kf,3-fluoranylbenzenesulfonamide,ksc180k2p,3-fluorobenzenesulfonamide PubChem CID: 150924 IUPAC Name: 3-fluorobenzenesulfonamide SMILES: C1=CC(=CC(=C1)S(=O)(=O)N)F
| PubChem CID | 150924 |
|---|---|
| CAS | 1524-40-9 |
| Molecular Weight (g/mol) | 175.177 |
| MDL Number | MFCD00042284 |
| SMILES | C1=CC(=CC(=C1)S(=O)(=O)N)F |
| Synonym | 3-fluorobenzene-1-sulfonamide,benzenesulfonamide, 3-fluoro,3-fluorobenzenesulphonamide,3-fbsa,2weo,pubchem11762,acmc-20a5kf,3-fluoranylbenzenesulfonamide,ksc180k2p,3-fluorobenzenesulfonamide |
| IUPAC Name | 3-fluorobenzenesulfonamide |
| InChI Key | CRINBBOGNYCAOV-UHFFFAOYSA-N |
| Molecular Formula | C6H6FNO2S |
3,4-Dichlorobenzyl Cyanide 98.0+%, TCI America™
CAS: 3218-49-3 Molecular Formula: C8H5Cl2N Molecular Weight (g/mol): 186.04 MDL Number: MFCD00001909 InChI Key: QWZNCAFWRZZJMA-UHFFFAOYSA-N Synonym: 3,4-dichlorophenylacetonitrile,2-3,4-dichlorophenyl acetonitrile,3,4-dichlorobenzyl cyanide,3,4-dichlorophenyl acetonitrile,benzeneacetonitrile, 3,4-dichloro,3,4-dichlorobenzeneacetonitrile,2-3,4-dichlorophenyl ethanenitrile,3,4-dichlorphenyl acetonitrile,pubchem16506,3,4-dichlorobenzylcyanide PubChem CID: 76690 IUPAC Name: 2-(3,4-dichlorophenyl)acetonitrile SMILES: ClC1=CC=C(CC#N)C=C1Cl
| PubChem CID | 76690 |
|---|---|
| CAS | 3218-49-3 |
| Molecular Weight (g/mol) | 186.04 |
| MDL Number | MFCD00001909 |
| SMILES | ClC1=CC=C(CC#N)C=C1Cl |
| Synonym | 3,4-dichlorophenylacetonitrile,2-3,4-dichlorophenyl acetonitrile,3,4-dichlorobenzyl cyanide,3,4-dichlorophenyl acetonitrile,benzeneacetonitrile, 3,4-dichloro,3,4-dichlorobenzeneacetonitrile,2-3,4-dichlorophenyl ethanenitrile,3,4-dichlorphenyl acetonitrile,pubchem16506,3,4-dichlorobenzylcyanide |
| IUPAC Name | 2-(3,4-dichlorophenyl)acetonitrile |
| InChI Key | QWZNCAFWRZZJMA-UHFFFAOYSA-N |
| Molecular Formula | C8H5Cl2N |
BD140 98.0+%, TCI America™
CAS: 1201643-08-4 Molecular Formula: C21H21BF2N2O Molecular Weight (g/mol): 366.219 InChI Key: NDQRWYKJLFZGBK-RMKNXTFCSA-N Synonym: 4,4-Difluoro-1-methyl-3-(4-propoxystyryl)-4-bora-3a,4a-diaza-s-indacene PubChem CID: 72198885 SMILES: [B-]1(N2C(=CC(=C2C=C3[N+]1=CC=C3)C)C=CC4=CC=C(C=C4)OCCC)(F)F
| PubChem CID | 72198885 |
|---|---|
| CAS | 1201643-08-4 |
| Molecular Weight (g/mol) | 366.219 |
| SMILES | [B-]1(N2C(=CC(=C2C=C3[N+]1=CC=C3)C)C=CC4=CC=C(C=C4)OCCC)(F)F |
| Synonym | 4,4-Difluoro-1-methyl-3-(4-propoxystyryl)-4-bora-3a,4a-diaza-s-indacene |
| InChI Key | NDQRWYKJLFZGBK-RMKNXTFCSA-N |
| Molecular Formula | C21H21BF2N2O |
2-Fluoro-3-(trifluoromethyl)benzonitrile 98.0+%, TCI America™
CAS: 146070-35-1 Molecular Formula: C8H3F4N Molecular Weight (g/mol): 189.113 MDL Number: MFCD00061152 InChI Key: NMWOWGXPPBIZNH-UHFFFAOYSA-N Synonym: 2-fluoro-3-trifluoromethyl benzonitrile,3-cyano-2-fluorobenzotrifluoride,.alpha.,.alpha.,.alpha.,2-tetrafluoro-m-tolunitrile,2-fluoro-3-trifluoromethyl benzenecarbonitrile,acmc-20anvp,buttpark 45\01-75,3-trifluoromethyl-2-fluorobenzonitrile,2-fluoro-3-trifluoromethyl-benzonitrile PubChem CID: 518974 IUPAC Name: 2-fluoro-3-(trifluoromethyl)benzonitrile SMILES: C1=CC(=C(C(=C1)C(F)(F)F)F)C#N
| PubChem CID | 518974 |
|---|---|
| CAS | 146070-35-1 |
| Molecular Weight (g/mol) | 189.113 |
| MDL Number | MFCD00061152 |
| SMILES | C1=CC(=C(C(=C1)C(F)(F)F)F)C#N |
| Synonym | 2-fluoro-3-trifluoromethyl benzonitrile,3-cyano-2-fluorobenzotrifluoride,.alpha.,.alpha.,.alpha.,2-tetrafluoro-m-tolunitrile,2-fluoro-3-trifluoromethyl benzenecarbonitrile,acmc-20anvp,buttpark 45\01-75,3-trifluoromethyl-2-fluorobenzonitrile,2-fluoro-3-trifluoromethyl-benzonitrile |
| IUPAC Name | 2-fluoro-3-(trifluoromethyl)benzonitrile |
| InChI Key | NMWOWGXPPBIZNH-UHFFFAOYSA-N |
| Molecular Formula | C8H3F4N |
3-Chloromethyl-5-nitrosalicylaldehyde 97.0+%, TCI America™
CAS: 16644-30-7 Molecular Formula: C8H6ClNO4 Molecular Weight (g/mol): 215.59 MDL Number: MFCD00191331 InChI Key: VPZKJFJWKLYFQD-UHFFFAOYSA-N PubChem CID: 99380 IUPAC Name: 3-(chloromethyl)-2-hydroxy-5-nitrobenzaldehyde SMILES: OC1=C(CCl)C=C(C=C1C=O)[N+]([O-])=O
| PubChem CID | 99380 |
|---|---|
| CAS | 16644-30-7 |
| Molecular Weight (g/mol) | 215.59 |
| MDL Number | MFCD00191331 |
| SMILES | OC1=C(CCl)C=C(C=C1C=O)[N+]([O-])=O |
| IUPAC Name | 3-(chloromethyl)-2-hydroxy-5-nitrobenzaldehyde |
| InChI Key | VPZKJFJWKLYFQD-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClNO4 |
2-Chlorobenzyl Bromide 98.0+%, TCI America™
CAS: 611-17-6 Molecular Formula: C7H6BrCl Molecular Weight (g/mol): 205.479 MDL Number: MFCD00000566 InChI Key: PURSZYWBIQIANP-UHFFFAOYSA-N Synonym: 2-chlorobenzyl bromide,1-bromomethyl-2-chlorobenzene,o-chlorobenzyl bromide,2-chlorobenzylbromide,benzene, 1-bromomethyl-2-chloro,alpha-bromo-2-chlorotoluene,unii-cev23h8uv4,2chlorobenzyl bromide,alpha-bromo-o-chlorotoluene,cev23h8uv4 PubChem CID: 11905 IUPAC Name: 1-(bromomethyl)-2-chlorobenzene SMILES: C1=CC=C(C(=C1)CBr)Cl
| PubChem CID | 11905 |
|---|---|
| CAS | 611-17-6 |
| Molecular Weight (g/mol) | 205.479 |
| MDL Number | MFCD00000566 |
| SMILES | C1=CC=C(C(=C1)CBr)Cl |
| Synonym | 2-chlorobenzyl bromide,1-bromomethyl-2-chlorobenzene,o-chlorobenzyl bromide,2-chlorobenzylbromide,benzene, 1-bromomethyl-2-chloro,alpha-bromo-2-chlorotoluene,unii-cev23h8uv4,2chlorobenzyl bromide,alpha-bromo-o-chlorotoluene,cev23h8uv4 |
| IUPAC Name | 1-(bromomethyl)-2-chlorobenzene |
| InChI Key | PURSZYWBIQIANP-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrCl |
4-Methoxy-2-nitroaniline 98.0+%, TCI America™
CAS: 96-96-8 Molecular Formula: C7H8N2O3 Molecular Weight (g/mol): 168.152 MDL Number: MFCD00007152 InChI Key: QFMJFXFXQAFGBO-UHFFFAOYSA-N Synonym: 2-nitro-4-methoxyaniline,4-amino-3-nitroanisole,fast bordeaux gp,2-nitro-p-anisidine,azobase nas,devol bordeaux b,bordeaux gp base,bordeaux gp salt,fast bordeaux gp base,fast bordeaux gp salt PubChem CID: 66793 ChEBI: CHEBI:48973 IUPAC Name: 4-methoxy-2-nitroaniline SMILES: COC1=CC(=C(C=C1)N)[N+](=O)[O-]
| PubChem CID | 66793 |
|---|---|
| CAS | 96-96-8 |
| Molecular Weight (g/mol) | 168.152 |
| ChEBI | CHEBI:48973 |
| MDL Number | MFCD00007152 |
| SMILES | COC1=CC(=C(C=C1)N)[N+](=O)[O-] |
| Synonym | 2-nitro-4-methoxyaniline,4-amino-3-nitroanisole,fast bordeaux gp,2-nitro-p-anisidine,azobase nas,devol bordeaux b,bordeaux gp base,bordeaux gp salt,fast bordeaux gp base,fast bordeaux gp salt |
| IUPAC Name | 4-methoxy-2-nitroaniline |
| InChI Key | QFMJFXFXQAFGBO-UHFFFAOYSA-N |
| Molecular Formula | C7H8N2O3 |
3,5-Dibromobenzotrifluoride 98.0+%, TCI America™
CAS: 401-84-3 Molecular Formula: C7H3Br2F3 Molecular Weight (g/mol): 303.90 MDL Number: MFCD00526219 InChI Key: OFNXSUANJLHGQN-UHFFFAOYSA-N Synonym: 1,3-dibromo-5-trifluoromethyl benzene,3,5-dibromobenzotrifluoride,benzene, 1,3-dibromo-5-trifluoromethyl,pubchem11234,acmc-209jbn,ksc911m2p,1,3-dibromobenzotrifluoride,3,5-dibromo-, ,-trifluorotoluene,3,5-dibromo-1-trifluoromethyl benzene,1,3-dibromo-5-trifluoromethyl ;benzene PubChem CID: 2063489 IUPAC Name: 1,3-dibromo-5-(trifluoromethyl)benzene SMILES: FC(F)(F)C1=CC(Br)=CC(Br)=C1
| PubChem CID | 2063489 |
|---|---|
| CAS | 401-84-3 |
| Molecular Weight (g/mol) | 303.90 |
| MDL Number | MFCD00526219 |
| SMILES | FC(F)(F)C1=CC(Br)=CC(Br)=C1 |
| Synonym | 1,3-dibromo-5-trifluoromethyl benzene,3,5-dibromobenzotrifluoride,benzene, 1,3-dibromo-5-trifluoromethyl,pubchem11234,acmc-209jbn,ksc911m2p,1,3-dibromobenzotrifluoride,3,5-dibromo-, ,-trifluorotoluene,3,5-dibromo-1-trifluoromethyl benzene,1,3-dibromo-5-trifluoromethyl ;benzene |
| IUPAC Name | 1,3-dibromo-5-(trifluoromethyl)benzene |
| InChI Key | OFNXSUANJLHGQN-UHFFFAOYSA-N |
| Molecular Formula | C7H3Br2F3 |
3-Hydroxybenzotrifluoride 98.0+%, TCI America™
CAS: 98-17-9 Molecular Formula: C7H5F3O Molecular Weight (g/mol): 162.111 MDL Number: MFCD00002299 InChI Key: UGEJOEBBMPOJMT-UHFFFAOYSA-N Synonym: 3-trifluoromethyl phenol,3-hydroxybenzotrifluoride,m-trifluoromethylphenol,m-hydroxybenzotrifluoride,phenol, 3-trifluoromethyl,m-trifluoromethyl phenol,alpha,alpha,alpha-trifluoro-m-cresol,a,a,a-trifluoro-m-cresol PubChem CID: 7376 IUPAC Name: 3-(trifluoromethyl)phenol SMILES: C1=CC(=CC(=C1)O)C(F)(F)F
| PubChem CID | 7376 |
|---|---|
| CAS | 98-17-9 |
| Molecular Weight (g/mol) | 162.111 |
| MDL Number | MFCD00002299 |
| SMILES | C1=CC(=CC(=C1)O)C(F)(F)F |
| Synonym | 3-trifluoromethyl phenol,3-hydroxybenzotrifluoride,m-trifluoromethylphenol,m-hydroxybenzotrifluoride,phenol, 3-trifluoromethyl,m-trifluoromethyl phenol,alpha,alpha,alpha-trifluoro-m-cresol,a,a,a-trifluoro-m-cresol |
| IUPAC Name | 3-(trifluoromethyl)phenol |
| InChI Key | UGEJOEBBMPOJMT-UHFFFAOYSA-N |
| Molecular Formula | C7H5F3O |
2-(Trifluoromethyl)benzyl Bromide 97.0+%, TCI America™
CAS: 395-44-8 Molecular Formula: C8H6BrF3 Molecular Weight (g/mol): 239.04 MDL Number: MFCD00013558 InChI Key: TXVVVEUSVBLDED-UHFFFAOYSA-N Synonym: 2-trifluoromethyl benzyl bromide,1-bromomethyl-2-trifluoromethyl benzene,2-trifluoromethylbenzyl bromide,2-trifluoromethyl benzylbromide,o-trifluoromethylbenzyl bromide,benzene, 1-bromomethyl-2-trifluoromethyl,o-trifluoromethyl benzyl bromide,alpha'-bromo-alpha,alpha,alpha-trifluoro-o-xylene,1-bromomethyl-2-trifluoromethyl-benzene,a'-bromo-a,a,a-trifluoro-o-xylene PubChem CID: 123057 IUPAC Name: 1-(bromomethyl)-2-(trifluoromethyl)benzene SMILES: FC(F)(F)C1=CC=CC=C1CBr
| PubChem CID | 123057 |
|---|---|
| CAS | 395-44-8 |
| Molecular Weight (g/mol) | 239.04 |
| MDL Number | MFCD00013558 |
| SMILES | FC(F)(F)C1=CC=CC=C1CBr |
| Synonym | 2-trifluoromethyl benzyl bromide,1-bromomethyl-2-trifluoromethyl benzene,2-trifluoromethylbenzyl bromide,2-trifluoromethyl benzylbromide,o-trifluoromethylbenzyl bromide,benzene, 1-bromomethyl-2-trifluoromethyl,o-trifluoromethyl benzyl bromide,alpha'-bromo-alpha,alpha,alpha-trifluoro-o-xylene,1-bromomethyl-2-trifluoromethyl-benzene,a'-bromo-a,a,a-trifluoro-o-xylene |
| IUPAC Name | 1-(bromomethyl)-2-(trifluoromethyl)benzene |
| InChI Key | TXVVVEUSVBLDED-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrF3 |
3,5-Bis(trifluoromethyl)-2-chloroaniline 98.0+%, TCI America™
CAS: 201593-90-0 Molecular Formula: C8H4ClF6N Molecular Weight (g/mol): 263.567 InChI Key: JKUFETFGEJPHEM-UHFFFAOYSA-N Synonym: 2-chloro-3,5-bis trifluoromethyl aniline,3,5-bis trifluoromethyl-2-chloroaniline,2-chloro-3,5-bis-trifluoromethyl aniline,benzenamine, 2-chloro-3,5-bis trifluoromethyl,3,5-bis trifluoromethyl-2-chlorophenylamine,pubchem2938,2-chloro-3,5-bis-trifluoromethyl-aniline,3,5-bis trifluoromethyl-2-chloro aniline,2-chloranyl-3,5-bis trifluoromethyl aniline,2-chloro-3,5-bis-trifluoromethyl-phenylamine PubChem CID: 2757429 IUPAC Name: 2-chloro-3,5-bis(trifluoromethyl)aniline SMILES: C1=C(C=C(C(=C1C(F)(F)F)Cl)N)C(F)(F)F
| PubChem CID | 2757429 |
|---|---|
| CAS | 201593-90-0 |
| Molecular Weight (g/mol) | 263.567 |
| SMILES | C1=C(C=C(C(=C1C(F)(F)F)Cl)N)C(F)(F)F |
| Synonym | 2-chloro-3,5-bis trifluoromethyl aniline,3,5-bis trifluoromethyl-2-chloroaniline,2-chloro-3,5-bis-trifluoromethyl aniline,benzenamine, 2-chloro-3,5-bis trifluoromethyl,3,5-bis trifluoromethyl-2-chlorophenylamine,pubchem2938,2-chloro-3,5-bis-trifluoromethyl-aniline,3,5-bis trifluoromethyl-2-chloro aniline,2-chloranyl-3,5-bis trifluoromethyl aniline,2-chloro-3,5-bis-trifluoromethyl-phenylamine |
| IUPAC Name | 2-chloro-3,5-bis(trifluoromethyl)aniline |
| InChI Key | JKUFETFGEJPHEM-UHFFFAOYSA-N |
| Molecular Formula | C8H4ClF6N |
4-Amino-3-chlorobenzotrifluoride 97.0+%, TCI America™
CAS: 39885-50-2 Molecular Formula: C7H5ClF3N Molecular Weight (g/mol): 195.57 MDL Number: MFCD00042563 InChI Key: MBBUTABXEITVNY-UHFFFAOYSA-N Synonym: 2-chloro-4-trifluoromethyl aniline,4-amino-3-chlorobenzotrifluoride,4-amino-5-chloro-benzotrifluoride,benzenamine, 2-chloro-4-trifluoromethyl,3-chloro-4-aminobenzotrifluoride,2-chloro-4-trifluoromethyl-phenylamine,2-chloro-4-trifluoromethyl benzenamine,2-chloro-4-trifluoromethyl phenylamine,4-amino-3-chloro-benzotrifluoride,pubchem2474 PubChem CID: 162001 IUPAC Name: 2-chloro-4-(trifluoromethyl)aniline SMILES: NC1=CC=C(C=C1Cl)C(F)(F)F
| PubChem CID | 162001 |
|---|---|
| CAS | 39885-50-2 |
| Molecular Weight (g/mol) | 195.57 |
| MDL Number | MFCD00042563 |
| SMILES | NC1=CC=C(C=C1Cl)C(F)(F)F |
| Synonym | 2-chloro-4-trifluoromethyl aniline,4-amino-3-chlorobenzotrifluoride,4-amino-5-chloro-benzotrifluoride,benzenamine, 2-chloro-4-trifluoromethyl,3-chloro-4-aminobenzotrifluoride,2-chloro-4-trifluoromethyl-phenylamine,2-chloro-4-trifluoromethyl benzenamine,2-chloro-4-trifluoromethyl phenylamine,4-amino-3-chloro-benzotrifluoride,pubchem2474 |
| IUPAC Name | 2-chloro-4-(trifluoromethyl)aniline |
| InChI Key | MBBUTABXEITVNY-UHFFFAOYSA-N |
| Molecular Formula | C7H5ClF3N |