Benzene and substituted derivatives
Filtered Search Results
Pentafluorobenzyl Alcohol 96.0+%, TCI America™
CAS: 440-60-8 Molecular Formula: C7H3F5O Molecular Weight (g/mol): 198.092 MDL Number: MFCD00004602 InChI Key: PGJYYCIOYBZTPU-UHFFFAOYSA-N Synonym: 2,3,4,5,6-pentafluorobenzyl alcohol,pentafluorobenzyl alcohol,perfluorophenyl methanol,pentafluorophenyl methanol,2,3,4,5,6-pentafluorophenyl methanol,2,3,4,5,6-pentafluorobenzenemethanol,hydroxymethyl pentafluorobenzene,benzenemethanol, 2,3,4,5,6-pentafluoro,pentafluorobenzylalcohol,2,3,4,5,6-pentafluorobenzylalcohol PubChem CID: 9923 ChEBI: CHEBI:44903 IUPAC Name: (2,3,4,5,6-pentafluorophenyl)methanol SMILES: C(C1=C(C(=C(C(=C1F)F)F)F)F)O
| PubChem CID | 9923 |
|---|---|
| CAS | 440-60-8 |
| Molecular Weight (g/mol) | 198.092 |
| ChEBI | CHEBI:44903 |
| MDL Number | MFCD00004602 |
| SMILES | C(C1=C(C(=C(C(=C1F)F)F)F)F)O |
| Synonym | 2,3,4,5,6-pentafluorobenzyl alcohol,pentafluorobenzyl alcohol,perfluorophenyl methanol,pentafluorophenyl methanol,2,3,4,5,6-pentafluorophenyl methanol,2,3,4,5,6-pentafluorobenzenemethanol,hydroxymethyl pentafluorobenzene,benzenemethanol, 2,3,4,5,6-pentafluoro,pentafluorobenzylalcohol,2,3,4,5,6-pentafluorobenzylalcohol |
| IUPAC Name | (2,3,4,5,6-pentafluorophenyl)methanol |
| InChI Key | PGJYYCIOYBZTPU-UHFFFAOYSA-N |
| Molecular Formula | C7H3F5O |
3-Methyl-1-(3'-sulfoamidophenyl)-5-pyrazolone 95.0+%, TCI America™
CAS: 89-29-2 Molecular Formula: C10H11N3O3S Molecular Weight (g/mol): 253.28 MDL Number: MFCD00035707 InChI Key: ASVVGQURNHNITH-UHFFFAOYSA-N PubChem CID: 66634 IUPAC Name: 3-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzene-1-sulfonamide SMILES: CC1=NN(C(=O)C1)C1=CC=CC(=C1)S(N)(=O)=O
| PubChem CID | 66634 |
|---|---|
| CAS | 89-29-2 |
| Molecular Weight (g/mol) | 253.28 |
| MDL Number | MFCD00035707 |
| SMILES | CC1=NN(C(=O)C1)C1=CC=CC(=C1)S(N)(=O)=O |
| IUPAC Name | 3-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzene-1-sulfonamide |
| InChI Key | ASVVGQURNHNITH-UHFFFAOYSA-N |
| Molecular Formula | C10H11N3O3S |
3,6-Bis(chloromethyl)durene 98.0+%, TCI America™
CAS: 3022-16-0 Molecular Formula: C12H16Cl2 Molecular Weight (g/mol): 231.16 MDL Number: MFCD00018883 InChI Key: PGFAKOSRZYDFLR-UHFFFAOYSA-N Synonym: 1,4-Bis(chloromethyl)-2,3,5,6-tetramethylbenzene PubChem CID: 76402 IUPAC Name: 1,4-bis(chloromethyl)-2,3,5,6-tetramethylbenzene SMILES: CC1=C(C(=C(C(=C1CCl)C)C)CCl)C
| PubChem CID | 76402 |
|---|---|
| CAS | 3022-16-0 |
| Molecular Weight (g/mol) | 231.16 |
| MDL Number | MFCD00018883 |
| SMILES | CC1=C(C(=C(C(=C1CCl)C)C)CCl)C |
| Synonym | 1,4-Bis(chloromethyl)-2,3,5,6-tetramethylbenzene |
| IUPAC Name | 1,4-bis(chloromethyl)-2,3,5,6-tetramethylbenzene |
| InChI Key | PGFAKOSRZYDFLR-UHFFFAOYSA-N |
| Molecular Formula | C12H16Cl2 |
p-Anisidine-2-sulfonic Acid 97.0+%, TCI America™
CAS: 13244-33-2 Molecular Formula: C7H9NO4S Molecular Weight (g/mol): 203.212 MDL Number: MFCD00035804 InChI Key: KZKGEEGADAWJFS-UHFFFAOYSA-N Synonym: 4-aminoanisole-3-sulfonic acid,p-anisidine-3-sulfonic acid,benzenesulfonic acid, 2-amino-5-methoxy,4-methoxy-2-sulfoaniline,2-amino-5-methoxybenzenesulphonic acid,unii-hju535j932,2-amino-5-methoxybenzene-1-sulfonic acid,4-methoxyaniline-2-sulfonic acid,4-anisidine-2-sulfonicacid,2-amino-5-methoxy benzenesulfonic acid PubChem CID: 83260 IUPAC Name: 2-amino-5-methoxybenzenesulfonic acid SMILES: COC1=CC(=C(C=C1)N)S(=O)(=O)O
| PubChem CID | 83260 |
|---|---|
| CAS | 13244-33-2 |
| Molecular Weight (g/mol) | 203.212 |
| MDL Number | MFCD00035804 |
| SMILES | COC1=CC(=C(C=C1)N)S(=O)(=O)O |
| Synonym | 4-aminoanisole-3-sulfonic acid,p-anisidine-3-sulfonic acid,benzenesulfonic acid, 2-amino-5-methoxy,4-methoxy-2-sulfoaniline,2-amino-5-methoxybenzenesulphonic acid,unii-hju535j932,2-amino-5-methoxybenzene-1-sulfonic acid,4-methoxyaniline-2-sulfonic acid,4-anisidine-2-sulfonicacid,2-amino-5-methoxy benzenesulfonic acid |
| IUPAC Name | 2-amino-5-methoxybenzenesulfonic acid |
| InChI Key | KZKGEEGADAWJFS-UHFFFAOYSA-N |
| Molecular Formula | C7H9NO4S |
2-Methoxyphenyl Isocyanate 98.0+%, TCI America™
CAS: 700-87-8 Molecular Formula: C8H7NO2 Molecular Weight (g/mol): 149.15 MDL Number: MFCD00002004 InChI Key: SUVCZZADQDCIEQ-UHFFFAOYSA-N Synonym: 2-methoxyphenyl isocyanate,2-methoxyphenylisocyanate,benzene, 1-isocyanato-2-methoxy,o-methoxyphenyl isocyanate,2-isocyanatoanisole,1-isocyanato-2-methoxy-benzene,o-anisylisocyanate,2-methoxybenzenisocyanate,o-anisyl isocyanate,methoxyphenyl isocyanate PubChem CID: 69695 IUPAC Name: 1-isocyanato-2-methoxybenzene SMILES: COC1=CC=CC=C1N=C=O
| PubChem CID | 69695 |
|---|---|
| CAS | 700-87-8 |
| Molecular Weight (g/mol) | 149.15 |
| MDL Number | MFCD00002004 |
| SMILES | COC1=CC=CC=C1N=C=O |
| Synonym | 2-methoxyphenyl isocyanate,2-methoxyphenylisocyanate,benzene, 1-isocyanato-2-methoxy,o-methoxyphenyl isocyanate,2-isocyanatoanisole,1-isocyanato-2-methoxy-benzene,o-anisylisocyanate,2-methoxybenzenisocyanate,o-anisyl isocyanate,methoxyphenyl isocyanate |
| IUPAC Name | 1-isocyanato-2-methoxybenzene |
| InChI Key | SUVCZZADQDCIEQ-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO2 |
2,5-Dibromobenzotrifluoride 98.0+%, TCI America™
CAS: 7657-09-2 Molecular Formula: C7H3Br2F3 Molecular Weight (g/mol): 303.90 MDL Number: MFCD00013554 InChI Key: VWKFJAOCLPPQGR-UHFFFAOYSA-N Synonym: 1,4-dibromo-2-trifluoromethyl benzene,2,5-dibromobenzotrifluoride,benzene, 1,4-dibromo-2-trifluoromethyl,2,5-dibromo trifluoromethyl benzene,1,4-dibromo-2-trifluoromethyl-benzene,toluene, 2,5-dibromo-alpha,alpha,alpha-trifluoro,pubchem9537,2,5-dibromobenzotrifloride,2,5-dibromo-, ,-trifluorotoluene PubChem CID: 82108 IUPAC Name: 1,4-dibromo-2-(trifluoromethyl)benzene SMILES: FC(F)(F)C1=CC(Br)=CC=C1Br
| PubChem CID | 82108 |
|---|---|
| CAS | 7657-09-2 |
| Molecular Weight (g/mol) | 303.90 |
| MDL Number | MFCD00013554 |
| SMILES | FC(F)(F)C1=CC(Br)=CC=C1Br |
| Synonym | 1,4-dibromo-2-trifluoromethyl benzene,2,5-dibromobenzotrifluoride,benzene, 1,4-dibromo-2-trifluoromethyl,2,5-dibromo trifluoromethyl benzene,1,4-dibromo-2-trifluoromethyl-benzene,toluene, 2,5-dibromo-alpha,alpha,alpha-trifluoro,pubchem9537,2,5-dibromobenzotrifloride,2,5-dibromo-, ,-trifluorotoluene |
| IUPAC Name | 1,4-dibromo-2-(trifluoromethyl)benzene |
| InChI Key | VWKFJAOCLPPQGR-UHFFFAOYSA-N |
| Molecular Formula | C7H3Br2F3 |
4-Nitrotoluene-2-sulfonic Acid Hydrate 95.0+%, TCI America™
CAS: 121-03-9 Molecular Formula: C7H7NO5S Molecular Weight (g/mol): 217.195 MDL Number: MFCD00024914 InChI Key: ZDTXQHVBLWYPHS-UHFFFAOYSA-N PubChem CID: 8458 ChEBI: CHEBI:67120 SMILES: CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)O
| PubChem CID | 8458 |
|---|---|
| CAS | 121-03-9 |
| Molecular Weight (g/mol) | 217.195 |
| ChEBI | CHEBI:67120 |
| MDL Number | MFCD00024914 |
| SMILES | CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)O |
| InChI Key | ZDTXQHVBLWYPHS-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO5S |
4-(Difluoromethoxy)benzoic Acid 98.0+%, TCI America™
CAS: 4837-20-1 Molecular Formula: C8H5F2O3 Molecular Weight (g/mol): 187.12 MDL Number: MFCD00221454 InChI Key: BSNNYLYELGBSBA-UHFFFAOYSA-M Synonym: 4-difluoromethoxy benzoic acid,4-difluoromethoxy-benzoic acid,benzoic acid, 4-difluoromethoxy,pubchem3933,acmc-20a19a,p-difluoromethoxy benzoic acid,alpha,alpha-difluoro-p-anisic acid,4-difluoromethyl oxy benzoic acid PubChem CID: 737360 IUPAC Name: 4-(difluoromethoxy)benzoate SMILES: [O-]C(=O)C1=CC=C(OC(F)F)C=C1
| PubChem CID | 737360 |
|---|---|
| CAS | 4837-20-1 |
| Molecular Weight (g/mol) | 187.12 |
| MDL Number | MFCD00221454 |
| SMILES | [O-]C(=O)C1=CC=C(OC(F)F)C=C1 |
| Synonym | 4-difluoromethoxy benzoic acid,4-difluoromethoxy-benzoic acid,benzoic acid, 4-difluoromethoxy,pubchem3933,acmc-20a19a,p-difluoromethoxy benzoic acid,alpha,alpha-difluoro-p-anisic acid,4-difluoromethyl oxy benzoic acid |
| IUPAC Name | 4-(difluoromethoxy)benzoate |
| InChI Key | BSNNYLYELGBSBA-UHFFFAOYSA-M |
| Molecular Formula | C8H5F2O3 |
4-Fluoroaniline 98.0+%, TCI America™
CAS: 371-40-4 Molecular Formula: C6H6FN Molecular Weight (g/mol): 111.12 MDL Number: MFCD00007829 InChI Key: KRZCOLNOCZKSDF-UHFFFAOYSA-N Synonym: p-fluoroaniline,benzenamine, 4-fluoro,1-amino-4-fluorobenzene,4-fluorobenzenamine,p-fluorophenylamine,4-fluoronaniline,aniline, p-fluoro,aniline, 4-fluoro,4-fluoranilin,para-fluoroaniline PubChem CID: 9731 ChEBI: CHEBI:28546 IUPAC Name: 4-fluoroaniline SMILES: NC1=CC=C(F)C=C1
| PubChem CID | 9731 |
|---|---|
| CAS | 371-40-4 |
| Molecular Weight (g/mol) | 111.12 |
| ChEBI | CHEBI:28546 |
| MDL Number | MFCD00007829 |
| SMILES | NC1=CC=C(F)C=C1 |
| Synonym | p-fluoroaniline,benzenamine, 4-fluoro,1-amino-4-fluorobenzene,4-fluorobenzenamine,p-fluorophenylamine,4-fluoronaniline,aniline, p-fluoro,aniline, 4-fluoro,4-fluoranilin,para-fluoroaniline |
| IUPAC Name | 4-fluoroaniline |
| InChI Key | KRZCOLNOCZKSDF-UHFFFAOYSA-N |
| Molecular Formula | C6H6FN |
2,4-Dimethoxybenzylamine 98.0+%, TCI America™
CAS: 20781-20-8 Molecular Formula: C9H13NO2 Molecular Weight (g/mol): 167.208 MDL Number: MFCD00052393 InChI Key: QOWBXWFYRXSBAS-UHFFFAOYSA-N Synonym: 2,4-dimethoxybenzylamine,2,4-dimethoxyphenyl methanamine,2,4-dimethoxy benzylamine,1-2,4-dimethoxyphenyl methanamine,benzenemethanamine, 2,4-dimethoxy,2,4-dimethoxybenzyl amine,2,4-dimethoxyphenyl methylamine,2, 4-dimethoxybenzylamine,pubchem7398,2,4dimethoxybenzylamine PubChem CID: 597250 IUPAC Name: (2,4-dimethoxyphenyl)methanamine SMILES: COC1=CC(=C(C=C1)CN)OC
| PubChem CID | 597250 |
|---|---|
| CAS | 20781-20-8 |
| Molecular Weight (g/mol) | 167.208 |
| MDL Number | MFCD00052393 |
| SMILES | COC1=CC(=C(C=C1)CN)OC |
| Synonym | 2,4-dimethoxybenzylamine,2,4-dimethoxyphenyl methanamine,2,4-dimethoxy benzylamine,1-2,4-dimethoxyphenyl methanamine,benzenemethanamine, 2,4-dimethoxy,2,4-dimethoxybenzyl amine,2,4-dimethoxyphenyl methylamine,2, 4-dimethoxybenzylamine,pubchem7398,2,4dimethoxybenzylamine |
| IUPAC Name | (2,4-dimethoxyphenyl)methanamine |
| InChI Key | QOWBXWFYRXSBAS-UHFFFAOYSA-N |
| Molecular Formula | C9H13NO2 |
2-Bromo-5-nitrotoluene 98.0+%, TCI America™
CAS: 7149-70-4 Molecular Formula: C7H6BrNO2 Molecular Weight (g/mol): 216.034 MDL Number: MFCD00007281 InChI Key: HIMGPQVBNICCGL-UHFFFAOYSA-N Synonym: 2-bromo-5-nitrotoluene,4-bromo-3-methylnitrobenzene,benzene, 1-bromo-2-methyl-4-nitro,bromo 5--2-nitrotoluene,2bromo-5-nitrotoluene,pubchem12553,acmc-209oiv,toluene, 2-bromo-5-nitro,ksc498a8d,methyl 2-bromo-5-nitrobenzene PubChem CID: 251672 IUPAC Name: 1-bromo-2-methyl-4-nitrobenzene SMILES: CC1=C(C=CC(=C1)[N+](=O)[O-])Br
| PubChem CID | 251672 |
|---|---|
| CAS | 7149-70-4 |
| Molecular Weight (g/mol) | 216.034 |
| MDL Number | MFCD00007281 |
| SMILES | CC1=C(C=CC(=C1)[N+](=O)[O-])Br |
| Synonym | 2-bromo-5-nitrotoluene,4-bromo-3-methylnitrobenzene,benzene, 1-bromo-2-methyl-4-nitro,bromo 5--2-nitrotoluene,2bromo-5-nitrotoluene,pubchem12553,acmc-209oiv,toluene, 2-bromo-5-nitro,ksc498a8d,methyl 2-bromo-5-nitrobenzene |
| IUPAC Name | 1-bromo-2-methyl-4-nitrobenzene |
| InChI Key | HIMGPQVBNICCGL-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrNO2 |
3,5,4'-Tribromosalicylanilide 98.0+%, TCI America™
CAS: 87-10-5 Molecular Formula: C13H8Br3NO2 Molecular Weight (g/mol): 449.92 MDL Number: MFCD00045740 InChI Key: KVSKGMLNBAPGKH-UHFFFAOYSA-N PubChem CID: 14868 ChEBI: CHEBI:127105 IUPAC Name: 3,5-dibromo-N-(4-bromophenyl)-2-hydroxybenzamide SMILES: OC1=C(Br)C=C(Br)C=C1C(=O)NC1=CC=C(Br)C=C1
| PubChem CID | 14868 |
|---|---|
| CAS | 87-10-5 |
| Molecular Weight (g/mol) | 449.92 |
| ChEBI | CHEBI:127105 |
| MDL Number | MFCD00045740 |
| SMILES | OC1=C(Br)C=C(Br)C=C1C(=O)NC1=CC=C(Br)C=C1 |
| IUPAC Name | 3,5-dibromo-N-(4-bromophenyl)-2-hydroxybenzamide |
| InChI Key | KVSKGMLNBAPGKH-UHFFFAOYSA-N |
| Molecular Formula | C13H8Br3NO2 |
Methyl N-Phenylcarbamate 98.0+%, TCI America™
CAS: 2603-10-3 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.17 MDL Number: MFCD00027552 InChI Key: IAGUPODHENSJEZ-UHFFFAOYSA-N Synonym: N-Phenylcarbamic Acid Methyl Ester PubChem CID: 17451 IUPAC Name: methyl N-phenylcarbamate SMILES: COC(=O)NC1=CC=CC=C1
| PubChem CID | 17451 |
|---|---|
| CAS | 2603-10-3 |
| Molecular Weight (g/mol) | 151.17 |
| MDL Number | MFCD00027552 |
| SMILES | COC(=O)NC1=CC=CC=C1 |
| Synonym | N-Phenylcarbamic Acid Methyl Ester |
| IUPAC Name | methyl N-phenylcarbamate |
| InChI Key | IAGUPODHENSJEZ-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO2 |
2,3-Dichloroanisole 97.0+%, TCI America™
CAS: 1984-59-4 Molecular Formula: C7H6Cl2O Molecular Weight (g/mol): 177.02 MDL Number: MFCD00000545 InChI Key: HFEASCCDHUVYKU-UHFFFAOYSA-N Synonym: 2,3-dichloroanisole,benzene, 1,2-dichloro-3-methoxy,2,3-dichloromethoxybenzene,2,3-dichloranisol,dichloroanisole 2,3-,1,2-dichloro-3-methoxy-benzene,dichloroanisol,2,3-dichloro-anisol,pubchem3680,2,3-dichloro anisole PubChem CID: 16126 IUPAC Name: 1,2-dichloro-3-methoxybenzene SMILES: COC1=CC=CC(Cl)=C1Cl
| PubChem CID | 16126 |
|---|---|
| CAS | 1984-59-4 |
| Molecular Weight (g/mol) | 177.02 |
| MDL Number | MFCD00000545 |
| SMILES | COC1=CC=CC(Cl)=C1Cl |
| Synonym | 2,3-dichloroanisole,benzene, 1,2-dichloro-3-methoxy,2,3-dichloromethoxybenzene,2,3-dichloranisol,dichloroanisole 2,3-,1,2-dichloro-3-methoxy-benzene,dichloroanisol,2,3-dichloro-anisol,pubchem3680,2,3-dichloro anisole |
| IUPAC Name | 1,2-dichloro-3-methoxybenzene |
| InChI Key | HFEASCCDHUVYKU-UHFFFAOYSA-N |
| Molecular Formula | C7H6Cl2O |
4',6,7-Trimethoxyisoflavone 97.0+%, TCI America™
CAS: 798-61-8 Molecular Formula: C18H16O5 Molecular Weight (g/mol): 312.321 MDL Number: MFCD00016949 InChI Key: YHXIOAVHEXKZCQ-UHFFFAOYSA-N Synonym: 6,7-Dimethoxy-3-(4-methoxyphenyl)chromone PubChem CID: 688655 IUPAC Name: 6,7-dimethoxy-3-(4-methoxyphenyl)chromen-4-one SMILES: COC1=CC=C(C=C1)C2=COC3=CC(=C(C=C3C2=O)OC)OC
| PubChem CID | 688655 |
|---|---|
| CAS | 798-61-8 |
| Molecular Weight (g/mol) | 312.321 |
| MDL Number | MFCD00016949 |
| SMILES | COC1=CC=C(C=C1)C2=COC3=CC(=C(C=C3C2=O)OC)OC |
| Synonym | 6,7-Dimethoxy-3-(4-methoxyphenyl)chromone |
| IUPAC Name | 6,7-dimethoxy-3-(4-methoxyphenyl)chromen-4-one |
| InChI Key | YHXIOAVHEXKZCQ-UHFFFAOYSA-N |
| Molecular Formula | C18H16O5 |