Benzene and substituted derivatives
Filtered Search Results
| PubChem CID | 2782670 |
|---|---|
| CAS | 182344-18-9 |
| Molecular Weight (g/mol) | 224.37 |
| MDL Number | MFCD00797335 |
| Color | White |
| Physical Form | Crystalline Powder |
| SMILES | B(C1=C(C=CC(=C1)C(F)(F)F)Cl)(O)O |
| TSCA | No |
| IUPAC Name | [2-chloro-5-(trifluoromethyl)phenyl]boronic acid |
| InChI Key | YVMXEHZEYONARR-UHFFFAOYSA-N |
| Molecular Formula | C7H5BClF3O2 |
| Formula Weight | 224.37 |
| Melting Point | 108°C |
2-Bromo-5-fluorobenzaldehyde 95.0+%, TCI America™
CAS: 94569-84-3 Molecular Formula: C7H4BrFO Molecular Weight (g/mol): 203.01 MDL Number: MFCD00142872 InChI Key: CJUCIKJLMFVWIS-UHFFFAOYSA-N Synonym: benzaldehyde, 2-bromo-5-fluoro,2-bromo-5-fluorobenzaldhyde,5-fluoro-2-bromo benzaldehyde,2-bromo-5-fluoro-benzaldehyde,pubchem1418,acmc-209rsk,ksc494g0d,2-bromo-5-fluoro benzaldehyde,2-bromo-5-fluorobenzaldehyde PubChem CID: 2773321 IUPAC Name: 2-bromo-5-fluorobenzaldehyde SMILES: C1=CC(=C(C=C1F)C=O)Br
| PubChem CID | 2773321 |
|---|---|
| CAS | 94569-84-3 |
| Molecular Weight (g/mol) | 203.01 |
| MDL Number | MFCD00142872 |
| SMILES | C1=CC(=C(C=C1F)C=O)Br |
| Synonym | benzaldehyde, 2-bromo-5-fluoro,2-bromo-5-fluorobenzaldhyde,5-fluoro-2-bromo benzaldehyde,2-bromo-5-fluoro-benzaldehyde,pubchem1418,acmc-209rsk,ksc494g0d,2-bromo-5-fluoro benzaldehyde,2-bromo-5-fluorobenzaldehyde |
| IUPAC Name | 2-bromo-5-fluorobenzaldehyde |
| InChI Key | CJUCIKJLMFVWIS-UHFFFAOYSA-N |
| Molecular Formula | C7H4BrFO |
Phenyl Trifluoromethyl Sulfone 98.0+%, TCI America™
CAS: 426-58-4 Molecular Formula: C7H5F3O2S Molecular Weight (g/mol): 210.17 MDL Number: MFCD00159083 InChI Key: UPGBQYFXKAKWQC-UHFFFAOYSA-N PubChem CID: 555605 IUPAC Name: trifluoromethylsulfonylbenzene SMILES: C1=CC=C(C=C1)S(=O)(=O)C(F)(F)F
| PubChem CID | 555605 |
|---|---|
| CAS | 426-58-4 |
| Molecular Weight (g/mol) | 210.17 |
| MDL Number | MFCD00159083 |
| SMILES | C1=CC=C(C=C1)S(=O)(=O)C(F)(F)F |
| IUPAC Name | trifluoromethylsulfonylbenzene |
| InChI Key | UPGBQYFXKAKWQC-UHFFFAOYSA-N |
| Molecular Formula | C7H5F3O2S |
3-(4-Hydroxy-3-methoxyphenyl)-1-propanol 98.0+%, TCI America™
CAS: 2305-13-7 Molecular Formula: C10H14O3 Molecular Weight (g/mol): 182.22 MDL Number: MFCD00016571 InChI Key: MWOMNLDJNQWJMK-UHFFFAOYSA-N Synonym: Dihydroconiferyl Alcohol PubChem CID: 16822 ChEBI: CHEBI:4559 IUPAC Name: 4-(3-hydroxypropyl)-2-methoxyphenol SMILES: COC1=CC(CCCO)=CC=C1O
| PubChem CID | 16822 |
|---|---|
| CAS | 2305-13-7 |
| Molecular Weight (g/mol) | 182.22 |
| ChEBI | CHEBI:4559 |
| MDL Number | MFCD00016571 |
| SMILES | COC1=CC(CCCO)=CC=C1O |
| Synonym | Dihydroconiferyl Alcohol |
| IUPAC Name | 4-(3-hydroxypropyl)-2-methoxyphenol |
| InChI Key | MWOMNLDJNQWJMK-UHFFFAOYSA-N |
| Molecular Formula | C10H14O3 |
2,3,4,5-Tetrachlorobenzoyl Chloride 98.0+%, TCI America™
CAS: 42221-52-3 Molecular Formula: C7HCl5O Molecular Weight (g/mol): 278.33 MDL Number: MFCD08460213 InChI Key: IROWIXYGGPOJFJ-UHFFFAOYSA-N PubChem CID: 5463797 IUPAC Name: 2,3,4,5-tetrachlorobenzoyl chloride SMILES: ClC(=O)C1=CC(Cl)=C(Cl)C(Cl)=C1Cl
| PubChem CID | 5463797 |
|---|---|
| CAS | 42221-52-3 |
| Molecular Weight (g/mol) | 278.33 |
| MDL Number | MFCD08460213 |
| SMILES | ClC(=O)C1=CC(Cl)=C(Cl)C(Cl)=C1Cl |
| IUPAC Name | 2,3,4,5-tetrachlorobenzoyl chloride |
| InChI Key | IROWIXYGGPOJFJ-UHFFFAOYSA-N |
| Molecular Formula | C7HCl5O |
Hexaethylene Glycol Monobenzyl Ether 93.0+%, TCI America™
CAS: 24342-68-5 Molecular Formula: C19H32O7 Molecular Weight (g/mol): 372.458 MDL Number: MFCD06797107 InChI Key: VVBQKDDPSXBMMZ-UHFFFAOYSA-N Synonym: 2-[2-[2-[2-[2-[2-(Benzyloxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol PubChem CID: 11164646 IUPAC Name: 2-[2-[2-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol SMILES: C1=CC=C(C=C1)COCCOCCOCCOCCOCCOCCO
| PubChem CID | 11164646 |
|---|---|
| CAS | 24342-68-5 |
| Molecular Weight (g/mol) | 372.458 |
| MDL Number | MFCD06797107 |
| SMILES | C1=CC=C(C=C1)COCCOCCOCCOCCOCCOCCO |
| Synonym | 2-[2-[2-[2-[2-[2-(Benzyloxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol |
| IUPAC Name | 2-[2-[2-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol |
| InChI Key | VVBQKDDPSXBMMZ-UHFFFAOYSA-N |
| Molecular Formula | C19H32O7 |
4-Bromo-2-nitrophenylacetic Acid 97.0+%, TCI America™
CAS: 6127-11-3 Molecular Formula: C8H5BrNO4 Molecular Weight (g/mol): 259.04 MDL Number: MFCD05663950 InChI Key: LBZPHZBNFDOCCR-UHFFFAOYSA-M PubChem CID: 271551 SMILES: C1=CC(=C(C=C1Br)[N+](=O)[O-])CC(=O)O
| PubChem CID | 271551 |
|---|---|
| CAS | 6127-11-3 |
| Molecular Weight (g/mol) | 259.04 |
| MDL Number | MFCD05663950 |
| SMILES | C1=CC(=C(C=C1Br)[N+](=O)[O-])CC(=O)O |
| InChI Key | LBZPHZBNFDOCCR-UHFFFAOYSA-M |
| Molecular Formula | C8H5BrNO4 |
4-Chloro-2-nitrobenzoic Acid 98.0+%, TCI America™
CAS: 6280-88-2 Molecular Formula: C7H4ClNO4 Molecular Weight (g/mol): 201.56 MDL Number: MFCD00007214 InChI Key: JAHIPDTWWVYVRV-UHFFFAOYSA-N Synonym: 4-chloro-2-nitrobenzoic acid,2-nitro-4-chlorobenzoic acid,4-chloro-2-nitrobenzoicacid,benzoic acid, 4-chloro-2-nitro,4-chloro-2-nitro-benzoic acid,acmc-1b6vn,ksc353a2d,2-carboxy-5-chloronitrobenzene,benzoicacid, 4-chloro-2-nitro,2-nitro-4-chlorobenzoic acid anion PubChem CID: 80475 IUPAC Name: 4-chloro-2-nitrobenzoic acid SMILES: OC(=O)C1=CC=C(Cl)C=C1[N+]([O-])=O
| PubChem CID | 80475 |
|---|---|
| CAS | 6280-88-2 |
| Molecular Weight (g/mol) | 201.56 |
| MDL Number | MFCD00007214 |
| SMILES | OC(=O)C1=CC=C(Cl)C=C1[N+]([O-])=O |
| Synonym | 4-chloro-2-nitrobenzoic acid,2-nitro-4-chlorobenzoic acid,4-chloro-2-nitrobenzoicacid,benzoic acid, 4-chloro-2-nitro,4-chloro-2-nitro-benzoic acid,acmc-1b6vn,ksc353a2d,2-carboxy-5-chloronitrobenzene,benzoicacid, 4-chloro-2-nitro,2-nitro-4-chlorobenzoic acid anion |
| IUPAC Name | 4-chloro-2-nitrobenzoic acid |
| InChI Key | JAHIPDTWWVYVRV-UHFFFAOYSA-N |
| Molecular Formula | C7H4ClNO4 |
1-Bromo-2,3,5,6-tetrafluorobenzene 97.0+%, TCI America™
CAS: 1559-88-2 Molecular Formula: C6HBrF4 Molecular Weight (g/mol): 228.97 MDL Number: MFCD00000308 InChI Key: YHAFCGSUIAFUCX-UHFFFAOYSA-N Synonym: 1-bromo-2,3,5,6-tetrafluorobenzene,2,3,5,6-tetrafluorobromobenzene,bromo-2,3,5,6-tetrafluorobenzene,1-bromo-2,3,5,6-tetrafluorbenzene,benzene, 3-bromo-1,2,4,5-tetrafluoro,2,3,5,6-tetrafluoro bromobenzene,2,3,5,6-tetrafluorobromo benzene,1,2,4,5-tetrafluoro-3-bromobenzene,pubchem2196,acmc-1bwvg PubChem CID: 73794 IUPAC Name: 3-bromo-1,2,4,5-tetrafluorobenzene SMILES: FC1=CC(F)=C(F)C(Br)=C1F
| PubChem CID | 73794 |
|---|---|
| CAS | 1559-88-2 |
| Molecular Weight (g/mol) | 228.97 |
| MDL Number | MFCD00000308 |
| SMILES | FC1=CC(F)=C(F)C(Br)=C1F |
| Synonym | 1-bromo-2,3,5,6-tetrafluorobenzene,2,3,5,6-tetrafluorobromobenzene,bromo-2,3,5,6-tetrafluorobenzene,1-bromo-2,3,5,6-tetrafluorbenzene,benzene, 3-bromo-1,2,4,5-tetrafluoro,2,3,5,6-tetrafluoro bromobenzene,2,3,5,6-tetrafluorobromo benzene,1,2,4,5-tetrafluoro-3-bromobenzene,pubchem2196,acmc-1bwvg |
| IUPAC Name | 3-bromo-1,2,4,5-tetrafluorobenzene |
| InChI Key | YHAFCGSUIAFUCX-UHFFFAOYSA-N |
| Molecular Formula | C6HBrF4 |
2-Bromo-1-chloro-4-fluorobenzene 98.0+%, TCI America™
CAS: 201849-15-2 Molecular Formula: C6H3BrClF Molecular Weight (g/mol): 209.44 MDL Number: MFCD00061120 InChI Key: FOCCSIJMXBTKHD-UHFFFAOYSA-N Synonym: 2-chloro-5-fluorobromobenzene,1-bromo-2-chloro-5-fluorobenzene,3-bromo-4-chlorofluorobenzene,2-bromo-1-chloro-4-fluoro-benzene,benzene, 2-bromo-1-chloro-4-fluoro,pubchem4270,acmc-209f6i,ksc494o8h,1-chloro-2-bromo-4-fluorobenzene,2-bromo-4-fluorochlorobenzene PubChem CID: 2773263 IUPAC Name: 2-bromo-1-chloro-4-fluorobenzene SMILES: FC1=CC(Br)=C(Cl)C=C1
| PubChem CID | 2773263 |
|---|---|
| CAS | 201849-15-2 |
| Molecular Weight (g/mol) | 209.44 |
| MDL Number | MFCD00061120 |
| SMILES | FC1=CC(Br)=C(Cl)C=C1 |
| Synonym | 2-chloro-5-fluorobromobenzene,1-bromo-2-chloro-5-fluorobenzene,3-bromo-4-chlorofluorobenzene,2-bromo-1-chloro-4-fluoro-benzene,benzene, 2-bromo-1-chloro-4-fluoro,pubchem4270,acmc-209f6i,ksc494o8h,1-chloro-2-bromo-4-fluorobenzene,2-bromo-4-fluorochlorobenzene |
| IUPAC Name | 2-bromo-1-chloro-4-fluorobenzene |
| InChI Key | FOCCSIJMXBTKHD-UHFFFAOYSA-N |
| Molecular Formula | C6H3BrClF |
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 |
Dimethyl 5-Hydroxyisophthalate 98.0+%, TCI America™
CAS: 13036-02-7 Molecular Formula: C10H10O5 Molecular Weight (g/mol): 210.19 MDL Number: MFCD00134367 InChI Key: DOSDTCPDBPRFHQ-UHFFFAOYSA-N PubChem CID: 83065 IUPAC Name: 1,3-dimethyl 5-hydroxybenzene-1,3-dicarboxylate SMILES: COC(=O)C1=CC(=CC(O)=C1)C(=O)OC
| PubChem CID | 83065 |
|---|---|
| CAS | 13036-02-7 |
| Molecular Weight (g/mol) | 210.19 |
| MDL Number | MFCD00134367 |
| SMILES | COC(=O)C1=CC(=CC(O)=C1)C(=O)OC |
| IUPAC Name | 1,3-dimethyl 5-hydroxybenzene-1,3-dicarboxylate |
| InChI Key | DOSDTCPDBPRFHQ-UHFFFAOYSA-N |
| Molecular Formula | C10H10O5 |
Benzyl Phenyl Ether 98.0+%, TCI America™
CAS: 946-80-5 Molecular Formula: C13H12O Molecular Weight (g/mol): 184.238 MDL Number: MFCD00020660 InChI Key: BOTNYLSAWDQNEX-UHFFFAOYSA-N Synonym: benzyl phenyl ether,benzyloxy benzene,phenyl benzyl ether,benzene, phenoxymethyl,ether, benzyl phenyl,benzylphenylether,benzyloxy-benzene,benzyloxybenzene,unii-bue863n0l8,.alpha.-phenylanisole PubChem CID: 70352 IUPAC Name: phenoxymethylbenzene SMILES: C1=CC=C(C=C1)COC2=CC=CC=C2
| PubChem CID | 70352 |
|---|---|
| CAS | 946-80-5 |
| Molecular Weight (g/mol) | 184.238 |
| MDL Number | MFCD00020660 |
| SMILES | C1=CC=C(C=C1)COC2=CC=CC=C2 |
| Synonym | benzyl phenyl ether,benzyloxy benzene,phenyl benzyl ether,benzene, phenoxymethyl,ether, benzyl phenyl,benzylphenylether,benzyloxy-benzene,benzyloxybenzene,unii-bue863n0l8,.alpha.-phenylanisole |
| IUPAC Name | phenoxymethylbenzene |
| InChI Key | BOTNYLSAWDQNEX-UHFFFAOYSA-N |
| Molecular Formula | C13H12O |
3'-Nitroacetanilide 98.0+%, TCI America™
CAS: 122-28-1 Molecular Formula: C8H8N2O3 Molecular Weight (g/mol): 180.163 MDL Number: MFCD00017015 InChI Key: KFTYNYHJHKCRKU-UHFFFAOYSA-N Synonym: n-3-nitrophenyl acetamide,3'-nitroacetanilide,m-nitroacetanilide,3-nitroacetanilide,acetamide, n-3-nitrophenyl,n-acetyl-m-nitroaniline,3-nitro-n-acetylaniline,acetanilide, 3'-nitro,unii-qgh8s22nbp,qgh8s22nbp PubChem CID: 31206 IUPAC Name: N-(3-nitrophenyl)acetamide SMILES: CC(=O)NC1=CC(=CC=C1)[N+](=O)[O-]
| PubChem CID | 31206 |
|---|---|
| CAS | 122-28-1 |
| Molecular Weight (g/mol) | 180.163 |
| MDL Number | MFCD00017015 |
| SMILES | CC(=O)NC1=CC(=CC=C1)[N+](=O)[O-] |
| Synonym | n-3-nitrophenyl acetamide,3'-nitroacetanilide,m-nitroacetanilide,3-nitroacetanilide,acetamide, n-3-nitrophenyl,n-acetyl-m-nitroaniline,3-nitro-n-acetylaniline,acetanilide, 3'-nitro,unii-qgh8s22nbp,qgh8s22nbp |
| IUPAC Name | N-(3-nitrophenyl)acetamide |
| InChI Key | KFTYNYHJHKCRKU-UHFFFAOYSA-N |
| Molecular Formula | C8H8N2O3 |
Ethyl 5-Bromo-2-chlorobenzoate 98.0+%, TCI America™
CAS: 76008-73-6 Molecular Formula: C9H8BrClO2 Molecular Weight (g/mol): 263.515 MDL Number: MFCD00013635 InChI Key: AMGWDYLEMSMUIO-UHFFFAOYSA-N Synonym: 5-bromo-2-chlorobenzoic acid ethyl ester,ethyl5-bromo-2-chlorobenzoate,benzoic acid, 5-bromo-2-chloro-, ethyl ester,pubchem3702,acmc-1bb9d,ethyl-5-bromo-2-chlorobenzoate,ethyl 5-bromo-2-chloro-benzoate,a-ethyl 5-bromo-2-chlorobenzoate,attercop-chm at115127,ethyl 5-bromo2-chlorobenzaldehyde PubChem CID: 144749 IUPAC Name: ethyl 5-bromo-2-chlorobenzoate SMILES: CCOC(=O)C1=C(C=CC(=C1)Br)Cl
| PubChem CID | 144749 |
|---|---|
| CAS | 76008-73-6 |
| Molecular Weight (g/mol) | 263.515 |
| MDL Number | MFCD00013635 |
| SMILES | CCOC(=O)C1=C(C=CC(=C1)Br)Cl |
| Synonym | 5-bromo-2-chlorobenzoic acid ethyl ester,ethyl5-bromo-2-chlorobenzoate,benzoic acid, 5-bromo-2-chloro-, ethyl ester,pubchem3702,acmc-1bb9d,ethyl-5-bromo-2-chlorobenzoate,ethyl 5-bromo-2-chloro-benzoate,a-ethyl 5-bromo-2-chlorobenzoate,attercop-chm at115127,ethyl 5-bromo2-chlorobenzaldehyde |
| IUPAC Name | ethyl 5-bromo-2-chlorobenzoate |
| InChI Key | AMGWDYLEMSMUIO-UHFFFAOYSA-N |
| Molecular Formula | C9H8BrClO2 |