Benzene and substituted derivatives
Filtered Search Results
Imidocarb Dipropionate 98.0+%, TCI America™
CAS: 55750-06-6 Molecular Formula: C25H32N6O5 Molecular Weight (g/mol): 496.568 MDL Number: MFCD00013161 InChI Key: AFGQXWSHYUHHNV-UHFFFAOYSA-N PubChem CID: 9983292 IUPAC Name: 1,3-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]urea;propanoic acid SMILES: CCC(=O)O.CCC(=O)O.C1CN=C(N1)C2=CC(=CC=C2)NC(=O)NC3=CC=CC(=C3)C4=NCCN4
| PubChem CID | 9983292 |
|---|---|
| CAS | 55750-06-6 |
| Molecular Weight (g/mol) | 496.568 |
| MDL Number | MFCD00013161 |
| SMILES | CCC(=O)O.CCC(=O)O.C1CN=C(N1)C2=CC(=CC=C2)NC(=O)NC3=CC=CC(=C3)C4=NCCN4 |
| IUPAC Name | 1,3-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]urea;propanoic acid |
| InChI Key | AFGQXWSHYUHHNV-UHFFFAOYSA-N |
| Molecular Formula | C25H32N6O5 |
Benzoyl Isothiocyanate 97.0+%, TCI America™
CAS: 532-55-8 Molecular Formula: C8H5NOS Molecular Weight (g/mol): 163.194 MDL Number: MFCD00004815 InChI Key: CPEKAXYCDKETEN-UHFFFAOYSA-N Synonym: benzoylthiocarbimide,benzoylisothiocyanate,benzoylisothiocyante,isothiocyanic acid benzoyl ester,unii-u8j7q32b86,n-benzoyl isothiocyanate,benzoic acid, anhydride with hncs,benzoic acid, anhydride with isothiocyanic acid,oxophenylmethanisothiocyanate,1-benzoyl acetone PubChem CID: 68284 IUPAC Name: benzoyl isothiocyanate SMILES: C1=CC=C(C=C1)C(=O)N=C=S
| PubChem CID | 68284 |
|---|---|
| CAS | 532-55-8 |
| Molecular Weight (g/mol) | 163.194 |
| MDL Number | MFCD00004815 |
| SMILES | C1=CC=C(C=C1)C(=O)N=C=S |
| Synonym | benzoylthiocarbimide,benzoylisothiocyanate,benzoylisothiocyante,isothiocyanic acid benzoyl ester,unii-u8j7q32b86,n-benzoyl isothiocyanate,benzoic acid, anhydride with hncs,benzoic acid, anhydride with isothiocyanic acid,oxophenylmethanisothiocyanate,1-benzoyl acetone |
| IUPAC Name | benzoyl isothiocyanate |
| InChI Key | CPEKAXYCDKETEN-UHFFFAOYSA-N |
| Molecular Formula | C8H5NOS |
5-Hydroxy-2-nitrobenzoic Acid 98.0+%, TCI America™
CAS: 610-37-7 Molecular Formula: C7H5NO5 Molecular Weight (g/mol): 183.119 MDL Number: MFCD00017566 InChI Key: BUHKQTKKZAXSMH-UHFFFAOYSA-N PubChem CID: 11882 SMILES: C1=CC(=C(C=C1O)C(=O)O)[N+](=O)[O-]
| PubChem CID | 11882 |
|---|---|
| CAS | 610-37-7 |
| Molecular Weight (g/mol) | 183.119 |
| MDL Number | MFCD00017566 |
| SMILES | C1=CC(=C(C=C1O)C(=O)O)[N+](=O)[O-] |
| InChI Key | BUHKQTKKZAXSMH-UHFFFAOYSA-N |
| Molecular Formula | C7H5NO5 |
Isopropamide Iodide 95.0+%, TCI America™
CAS: 71-81-8 Molecular Formula: C23H33IN2O Molecular Weight (g/mol): 480.434 MDL Number: MFCD00063513 InChI Key: BFSMWENDZZIWPW-UHFFFAOYSA-N Synonym: 4-Amino-N,N-diisopropyl-N-methyl-4-oxo-3,3-diphenyl-1-butanaminium Iodide, (3-Carbamoyl-3,3-diphenylpropyl)diisopropylmethylammonium Iodide PubChem CID: 6284 IUPAC Name: (4-amino-4-oxo-3,3-diphenylbutyl)-methyl-di(propan-2-yl)azanium;iodide SMILES: CC(C)[N+](C)(CCC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)N)C(C)C.[I-]
| PubChem CID | 6284 |
|---|---|
| CAS | 71-81-8 |
| Molecular Weight (g/mol) | 480.434 |
| MDL Number | MFCD00063513 |
| SMILES | CC(C)[N+](C)(CCC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)N)C(C)C.[I-] |
| Synonym | 4-Amino-N,N-diisopropyl-N-methyl-4-oxo-3,3-diphenyl-1-butanaminium Iodide, (3-Carbamoyl-3,3-diphenylpropyl)diisopropylmethylammonium Iodide |
| IUPAC Name | (4-amino-4-oxo-3,3-diphenylbutyl)-methyl-di(propan-2-yl)azanium;iodide |
| InChI Key | BFSMWENDZZIWPW-UHFFFAOYSA-N |
| Molecular Formula | C23H33IN2O |
2-(Isopropylsulfonyl)aniline 98.0+%, TCI America™
CAS: 76697-50-2 Molecular Formula: C9H13NO2S Molecular Weight (g/mol): 199.27 MDL Number: MFCD08445603 InChI Key: GMLAMRMKROYXNZ-UHFFFAOYSA-N Synonym: 2-Aminophenyl Isopropyl Sulfone PubChem CID: 12646366 IUPAC Name: 2-(propane-2-sulfonyl)aniline SMILES: CC(C)S(=O)(=O)C1=CC=CC=C1N
| PubChem CID | 12646366 |
|---|---|
| CAS | 76697-50-2 |
| Molecular Weight (g/mol) | 199.27 |
| MDL Number | MFCD08445603 |
| SMILES | CC(C)S(=O)(=O)C1=CC=CC=C1N |
| Synonym | 2-Aminophenyl Isopropyl Sulfone |
| IUPAC Name | 2-(propane-2-sulfonyl)aniline |
| InChI Key | GMLAMRMKROYXNZ-UHFFFAOYSA-N |
| Molecular Formula | C9H13NO2S |
2-Iodo-5-nitrotoluene 96.0+%, TCI America™
CAS: 5326-38-5 Molecular Formula: C7H6INO2 Molecular Weight (g/mol): 263.03 MDL Number: MFCD00051517 InChI Key: ARJHCXYRCLMLQN-UHFFFAOYSA-N Synonym: 2-iodo-5-nitrotoluene,benzene, 1-iodo-2-methyl-4-nitro,1-iodo-2-methyl-4-nitro-benzene,acmc-1amrp,2-jod-5-nitro-1-methylbenzol,benzene,1-iodo-2-methyl-4-nitro PubChem CID: 79225 IUPAC Name: 1-iodo-2-methyl-4-nitrobenzene SMILES: CC1=CC(=CC=C1I)[N+]([O-])=O
| PubChem CID | 79225 |
|---|---|
| CAS | 5326-38-5 |
| Molecular Weight (g/mol) | 263.03 |
| MDL Number | MFCD00051517 |
| SMILES | CC1=CC(=CC=C1I)[N+]([O-])=O |
| Synonym | 2-iodo-5-nitrotoluene,benzene, 1-iodo-2-methyl-4-nitro,1-iodo-2-methyl-4-nitro-benzene,acmc-1amrp,2-jod-5-nitro-1-methylbenzol,benzene,1-iodo-2-methyl-4-nitro |
| IUPAC Name | 1-iodo-2-methyl-4-nitrobenzene |
| InChI Key | ARJHCXYRCLMLQN-UHFFFAOYSA-N |
| Molecular Formula | C7H6INO2 |
4-Amino-2-fluorobenzoic Acid 98.0+%, TCI America™
CAS: 446-31-1 Molecular Formula: C7H6FNO2 Molecular Weight (g/mol): 155.128 MDL Number: MFCD01569397 InChI Key: QHERSCUZBKDVOC-UHFFFAOYSA-N Synonym: 2-fluoro-4-aminobenzoic acid,4-amino-2-fluorobenzoicacid,4-amino-2-fluorobenzenecarboxylic acid,4-amino-2-fluoro-benzoic acid,4-carboxy-3-fluoroaniline,benzoic acid, 4-amino-2-fluoro,pubchem4693,acmc-209jz6,ksc237k0f,4-amino-2-fluoro benzoic acid PubChem CID: 302680 IUPAC Name: 4-amino-2-fluorobenzoic acid SMILES: C1=CC(=C(C=C1N)F)C(=O)O
| PubChem CID | 302680 |
|---|---|
| CAS | 446-31-1 |
| Molecular Weight (g/mol) | 155.128 |
| MDL Number | MFCD01569397 |
| SMILES | C1=CC(=C(C=C1N)F)C(=O)O |
| Synonym | 2-fluoro-4-aminobenzoic acid,4-amino-2-fluorobenzoicacid,4-amino-2-fluorobenzenecarboxylic acid,4-amino-2-fluoro-benzoic acid,4-carboxy-3-fluoroaniline,benzoic acid, 4-amino-2-fluoro,pubchem4693,acmc-209jz6,ksc237k0f,4-amino-2-fluoro benzoic acid |
| IUPAC Name | 4-amino-2-fluorobenzoic acid |
| InChI Key | QHERSCUZBKDVOC-UHFFFAOYSA-N |
| Molecular Formula | C7H6FNO2 |
2-Acetamidobenzaldehyde 98.0+%, TCI America™
CAS: 13493-47-5 Molecular Formula: C9H9NO2 Molecular Weight (g/mol): 163.18 MDL Number: MFCD06739581 InChI Key: OWMJAQBUFVTERI-UHFFFAOYSA-N PubChem CID: 326664 IUPAC Name: N-(2-formylphenyl)acetamide SMILES: CC(=O)NC1=CC=CC=C1C=O
| PubChem CID | 326664 |
|---|---|
| CAS | 13493-47-5 |
| Molecular Weight (g/mol) | 163.18 |
| MDL Number | MFCD06739581 |
| SMILES | CC(=O)NC1=CC=CC=C1C=O |
| IUPAC Name | N-(2-formylphenyl)acetamide |
| InChI Key | OWMJAQBUFVTERI-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO2 |
2-Iodotoluene (stabilized with Copper chip) 98.0+%, TCI America™
CAS: 615-37-2 Molecular Formula: C7H7I Molecular Weight (g/mol): 218.037 MDL Number: MFCD00001042 InChI Key: RINOYHWVBUKAQE-UHFFFAOYSA-N Synonym: 2-iodotoluene,o-iodotoluene,o-tolyl iodide,benzene, 1-iodo-2-methyl,o-methyliodobenzene,toluene, o-iodo,iodotoluene,ortho-iodotoluene,2-methyliodobenzene,unii-8ok4h85t07 PubChem CID: 5128 ChEBI: CHEBI:39813 IUPAC Name: 1-iodo-2-methylbenzene SMILES: CC1=CC=CC=C1I
| PubChem CID | 5128 |
|---|---|
| CAS | 615-37-2 |
| Molecular Weight (g/mol) | 218.037 |
| ChEBI | CHEBI:39813 |
| MDL Number | MFCD00001042 |
| SMILES | CC1=CC=CC=C1I |
| Synonym | 2-iodotoluene,o-iodotoluene,o-tolyl iodide,benzene, 1-iodo-2-methyl,o-methyliodobenzene,toluene, o-iodo,iodotoluene,ortho-iodotoluene,2-methyliodobenzene,unii-8ok4h85t07 |
| IUPAC Name | 1-iodo-2-methylbenzene |
| InChI Key | RINOYHWVBUKAQE-UHFFFAOYSA-N |
| Molecular Formula | C7H7I |
4-Iodo-4'-nitrobiphenyl 98.0+%, TCI America™
CAS: 29170-08-9 Molecular Formula: C12H8INO2 Molecular Weight (g/mol): 325.11 MDL Number: MFCD00024698 InChI Key: YEDVRRNLTGKJSW-UHFFFAOYSA-N PubChem CID: 120142 IUPAC Name: 4-iodo-4'-nitro-1,1'-biphenyl SMILES: [O-][N+](=O)C1=CC=C(C=C1)C1=CC=C(I)C=C1
| PubChem CID | 120142 |
|---|---|
| CAS | 29170-08-9 |
| Molecular Weight (g/mol) | 325.11 |
| MDL Number | MFCD00024698 |
| SMILES | [O-][N+](=O)C1=CC=C(C=C1)C1=CC=C(I)C=C1 |
| IUPAC Name | 4-iodo-4'-nitro-1,1'-biphenyl |
| InChI Key | YEDVRRNLTGKJSW-UHFFFAOYSA-N |
| Molecular Formula | C12H8INO2 |
3-Hydroxy-2-nitrobenzoic Acid 98.0+%, TCI America™
CAS: 602-00-6 Molecular Formula: C7H5NO5 Molecular Weight (g/mol): 183.119 MDL Number: MFCD00017003 InChI Key: KPDBKQKRDJPBRM-UHFFFAOYSA-N Synonym: 3-hydroxy-2-nitrobenzoic acid,3-hydroxy-2-nitrobenzoicacid,3-hydroxy-2-nitro-benzoic acid,2-nitro-3-hydroxybenzoic acid,pubchem8846,nitro-m-oxybenzoesaure,benzoic acid, hydroxynitro,ksc288q8j,acmc-1b214,2-nitro-3-oxidanyl-benzoic acid PubChem CID: 293291 SMILES: C1=CC(=C(C(=C1)O)[N+](=O)[O-])C(=O)O
| PubChem CID | 293291 |
|---|---|
| CAS | 602-00-6 |
| Molecular Weight (g/mol) | 183.119 |
| MDL Number | MFCD00017003 |
| SMILES | C1=CC(=C(C(=C1)O)[N+](=O)[O-])C(=O)O |
| Synonym | 3-hydroxy-2-nitrobenzoic acid,3-hydroxy-2-nitrobenzoicacid,3-hydroxy-2-nitro-benzoic acid,2-nitro-3-hydroxybenzoic acid,pubchem8846,nitro-m-oxybenzoesaure,benzoic acid, hydroxynitro,ksc288q8j,acmc-1b214,2-nitro-3-oxidanyl-benzoic acid |
| InChI Key | KPDBKQKRDJPBRM-UHFFFAOYSA-N |
| Molecular Formula | C7H5NO5 |
TBPE (=Tetrabromophenolphthalein Ethyl Ester Potassium Salt) 98.0+%, TCI America™
CAS: 62637-91-6 Molecular Formula: C22H13Br4KO4 Molecular Weight (g/mol): 700.06 MDL Number: MFCD00011662 InChI Key: WCIQBKUTYDIBJC-UHFFFAOYSA-M Synonym: potassium tetrabromophenolphthalein ethyl ester,tetrabromophenolphthalein ethyl ester potassium salt,potassium 2,6-dibromo-4-3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene 2-ethoxycarbonyl phenyl methyl phenolate,potassium 2,6-dibromo-4-3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene 2-ethoxycarbonyl phenyl methyl benzenolate,dj-2,benzoic acid, 2-3,5-dibromo-4-hydroxyphenyl 3,5-dibromo-4-oxo-2,5-cyclohexadien-1-ylidene methyl-, ethyl ester, potassium salt,benzoic acid, 2-3,5-dibromo-4-hydroxyphenyl 3,5-dibromo-4-oxo-2,5-cyclohexadien-1-ylidene methyl-, ethyl ester, potassium salt 1:1,tetrabromophenolphthalein ethyl ester potassium,3',3,5',5-tetrabromophenolphthalein ethyl ester potassium salt PubChem CID: 23689366 IUPAC Name: potassium 2,6-dibromo-4-[(3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene)[2-(ethoxycarbonyl)phenyl]methyl]benzen-1-olate SMILES: [K+].CCOC(=O)C1=CC=CC=C1C(C1=CC(Br)=C([O-])C(Br)=C1)=C1C=C(Br)C(=O)C(Br)=C1
| PubChem CID | 23689366 |
|---|---|
| CAS | 62637-91-6 |
| Molecular Weight (g/mol) | 700.06 |
| MDL Number | MFCD00011662 |
| SMILES | [K+].CCOC(=O)C1=CC=CC=C1C(C1=CC(Br)=C([O-])C(Br)=C1)=C1C=C(Br)C(=O)C(Br)=C1 |
| Synonym | potassium tetrabromophenolphthalein ethyl ester,tetrabromophenolphthalein ethyl ester potassium salt,potassium 2,6-dibromo-4-3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene 2-ethoxycarbonyl phenyl methyl phenolate,potassium 2,6-dibromo-4-3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene 2-ethoxycarbonyl phenyl methyl benzenolate,dj-2,benzoic acid, 2-3,5-dibromo-4-hydroxyphenyl 3,5-dibromo-4-oxo-2,5-cyclohexadien-1-ylidene methyl-, ethyl ester, potassium salt,benzoic acid, 2-3,5-dibromo-4-hydroxyphenyl 3,5-dibromo-4-oxo-2,5-cyclohexadien-1-ylidene methyl-, ethyl ester, potassium salt 1:1,tetrabromophenolphthalein ethyl ester potassium,3',3,5',5-tetrabromophenolphthalein ethyl ester potassium salt |
| IUPAC Name | potassium 2,6-dibromo-4-[(3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene)[2-(ethoxycarbonyl)phenyl]methyl]benzen-1-olate |
| InChI Key | WCIQBKUTYDIBJC-UHFFFAOYSA-M |
| Molecular Formula | C22H13Br4KO4 |
(S)-4-Isopropyl-3-(1-naphthylmethyl)-2,5,5-triphenyl-1,3,2-oxazaborolidine, TCI America™
CAS: 850661-66-4 Molecular Formula: C34H32BNO Molecular Weight (g/mol): 481.446 InChI Key: KMDAQDQUTLTEPL-XIFFEERXSA-N PubChem CID: 12195798 IUPAC Name: (4S)-3-(naphthalen-1-ylmethyl)-2,5,5-triphenyl-4-propan-2-yl-1,3,2-oxazaborolidine SMILES: B1(N(C(C(O1)(C2=CC=CC=C2)C3=CC=CC=C3)C(C)C)CC4=CC=CC5=CC=CC=C54)C6=CC=CC=C6
| PubChem CID | 12195798 |
|---|---|
| CAS | 850661-66-4 |
| Molecular Weight (g/mol) | 481.446 |
| SMILES | B1(N(C(C(O1)(C2=CC=CC=C2)C3=CC=CC=C3)C(C)C)CC4=CC=CC5=CC=CC=C54)C6=CC=CC=C6 |
| IUPAC Name | (4S)-3-(naphthalen-1-ylmethyl)-2,5,5-triphenyl-4-propan-2-yl-1,3,2-oxazaborolidine |
| InChI Key | KMDAQDQUTLTEPL-XIFFEERXSA-N |
| Molecular Formula | C34H32BNO |
Iodobenzene Diacetate 97.0+%, TCI America™
CAS: 3240-34-4 Molecular Formula: C10H11IO4 Molecular Weight (g/mol): 322.098 MDL Number: MFCD00008692 InChI Key: ZBIKORITPGTTGI-UHFFFAOYSA-N Synonym: iodobenzene diacetate,diacetoxyiodo benzene,iodosobenzene diacetate,phenyliodine diacetate,phenyliodo diacetate,phenyliodoso acetate,phenyliodosodiacetate,phenyliodoso diacetate,bis acetato phenyliodine,benzene, diacetoxyiodo PubChem CID: 76724 IUPAC Name: [acetyloxy(phenyl)-$l^{3}-iodanyl] acetate SMILES: CC(=O)OI(C1=CC=CC=C1)OC(=O)C
| PubChem CID | 76724 |
|---|---|
| CAS | 3240-34-4 |
| Molecular Weight (g/mol) | 322.098 |
| MDL Number | MFCD00008692 |
| SMILES | CC(=O)OI(C1=CC=CC=C1)OC(=O)C |
| Synonym | iodobenzene diacetate,diacetoxyiodo benzene,iodosobenzene diacetate,phenyliodine diacetate,phenyliodo diacetate,phenyliodoso acetate,phenyliodosodiacetate,phenyliodoso diacetate,bis acetato phenyliodine,benzene, diacetoxyiodo |
| IUPAC Name | [acetyloxy(phenyl)-$l^{3}-iodanyl] acetate |
| InChI Key | ZBIKORITPGTTGI-UHFFFAOYSA-N |
| Molecular Formula | C10H11IO4 |
Isobutyl 4-Hydroxybenzoate 99.0+%, TCI America™
CAS: 2-3-4247 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00020167 InChI Key: XPJVKCRENWUEJH-UHFFFAOYSA-N Synonym: isobutyl 4-hydroxybenzoate,isobutylparaben,isobutyl p-hydroxybenzoate,isobutyl paraben,isobutyl-4-hydroxybenzoate,isobutyl parahydroxybenzoate,4-hydroxybenzoic acid isobutyl ester,benzoic acid, 4-hydroxy-, 2-methylpropyl ester,p-oxybenzoesaureisobutylester,unii-0qqj25x58g PubChem CID: 20240 IUPAC Name: 2-methylpropyl 4-hydroxybenzoate SMILES: CC(C)COC(=O)C1=CC=C(C=C1)O
| PubChem CID | 20240 |
|---|---|
| CAS | 2-3-4247 |
| Molecular Weight (g/mol) | 194.23 |
| MDL Number | MFCD00020167 |
| SMILES | CC(C)COC(=O)C1=CC=C(C=C1)O |
| Synonym | isobutyl 4-hydroxybenzoate,isobutylparaben,isobutyl p-hydroxybenzoate,isobutyl paraben,isobutyl-4-hydroxybenzoate,isobutyl parahydroxybenzoate,4-hydroxybenzoic acid isobutyl ester,benzoic acid, 4-hydroxy-, 2-methylpropyl ester,p-oxybenzoesaureisobutylester,unii-0qqj25x58g |
| IUPAC Name | 2-methylpropyl 4-hydroxybenzoate |
| InChI Key | XPJVKCRENWUEJH-UHFFFAOYSA-N |
| Molecular Formula | C11H14O3 |