Benzenoids
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Methyl 5-Iodosalicylate 98.0+%, TCI America™
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CAS: 4068-75-1 Molecular Formula: C8H7IO3 Molecular Weight (g/mol): 278.045 MDL Number: MFCD00016462 InChI Key: NRSWJTRJHPRZMH-UHFFFAOYSA-N Synonym: methyl 5-iodosalicylate,5-iodosalicylic acid methyl ester,2-hydroxy-5-iodobenzoic acid methyl ester,benzoic acid, 2-hydroxy-5-iodo-, methyl ester,methyl 2-hydroxy-5-iodobenzenecarboxylate,salicylic acid, 5-iodo-, methyl ester,methyl5-iodosalicylate,methyl-5-iodosalicylate,acmc-209jg0,methyl2-hydroxy-5-iodobenzoate PubChem CID: 248910 IUPAC Name: methyl 2-hydroxy-5-iodobenzoate SMILES: COC(=O)C1=C(C=CC(=C1)I)O
| PubChem CID | 248910 |
|---|---|
| CAS | 4068-75-1 |
| Molecular Weight (g/mol) | 278.045 |
| MDL Number | MFCD00016462 |
| SMILES | COC(=O)C1=C(C=CC(=C1)I)O |
| Synonym | methyl 5-iodosalicylate,5-iodosalicylic acid methyl ester,2-hydroxy-5-iodobenzoic acid methyl ester,benzoic acid, 2-hydroxy-5-iodo-, methyl ester,methyl 2-hydroxy-5-iodobenzenecarboxylate,salicylic acid, 5-iodo-, methyl ester,methyl5-iodosalicylate,methyl-5-iodosalicylate,acmc-209jg0,methyl2-hydroxy-5-iodobenzoate |
| IUPAC Name | methyl 2-hydroxy-5-iodobenzoate |
| InChI Key | NRSWJTRJHPRZMH-UHFFFAOYSA-N |
| Molecular Formula | C8H7IO3 |
Ethyl 2-Ethoxybenzoate 98.0+%, TCI America™
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CAS: 6290-24-0 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00142907 InChI Key: OUZCDRGUTZLAGO-UHFFFAOYSA-N Synonym: 2-Ethoxybenzoic Acid Ethyl Ester PubChem CID: 221644 IUPAC Name: ethyl 2-ethoxybenzoate SMILES: CCOC1=CC=CC=C1C(=O)OCC
| PubChem CID | 221644 |
|---|---|
| CAS | 6290-24-0 |
| Molecular Weight (g/mol) | 194.23 |
| MDL Number | MFCD00142907 |
| SMILES | CCOC1=CC=CC=C1C(=O)OCC |
| Synonym | 2-Ethoxybenzoic Acid Ethyl Ester |
| IUPAC Name | ethyl 2-ethoxybenzoate |
| InChI Key | OUZCDRGUTZLAGO-UHFFFAOYSA-N |
| Molecular Formula | C11H14O3 |
2,8-Dimethylanthra[2,3-b:7,6-b']dithiophene (purified by sublimation), TCI America™
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CAS: 1392416-39-5 Molecular Formula: C20H14S2 Molecular Weight (g/mol): 318.452 InChI Key: JSJKBPBSELKJQI-UHFFFAOYSA-N Synonym: syn-DMADT PubChem CID: 102290570 SMILES: CC1=CC2=CC3=CC4=CC5=C(C=C4C=C3C=C2S1)SC(=C5)C
| PubChem CID | 102290570 |
|---|---|
| CAS | 1392416-39-5 |
| Molecular Weight (g/mol) | 318.452 |
| SMILES | CC1=CC2=CC3=CC4=CC5=C(C=C4C=C3C=C2S1)SC(=C5)C |
| Synonym | syn-DMADT |
| InChI Key | JSJKBPBSELKJQI-UHFFFAOYSA-N |
| Molecular Formula | C20H14S2 |
1,3-Bis[2-(4-aminophenyl)-2-propyl]benzene 98.0+%, TCI America™
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CAS: 2687-27-6 Molecular Formula: C24H28N2 Molecular Weight (g/mol): 344.502 MDL Number: MFCD00274255 InChI Key: KWOIWTRRPFHBSI-UHFFFAOYSA-N Synonym: alpha,alpha′C-Bis(4-aminophenyl)-1,3-diisopropylbenzene, Bisaniline M, 4,4′C-(1,3-Phenylenediisopropylidene)bisaniline PubChem CID: 3292101 IUPAC Name: 4-[2-[3-[2-(4-aminophenyl)propan-2-yl]phenyl]propan-2-yl]aniline SMILES: CC(C)(C1=CC=C(C=C1)N)C2=CC(=CC=C2)C(C)(C)C3=CC=C(C=C3)N
| PubChem CID | 3292101 |
|---|---|
| CAS | 2687-27-6 |
| Molecular Weight (g/mol) | 344.502 |
| MDL Number | MFCD00274255 |
| SMILES | CC(C)(C1=CC=C(C=C1)N)C2=CC(=CC=C2)C(C)(C)C3=CC=C(C=C3)N |
| Synonym | alpha,alpha′C-Bis(4-aminophenyl)-1,3-diisopropylbenzene, Bisaniline M, 4,4′C-(1,3-Phenylenediisopropylidene)bisaniline |
| IUPAC Name | 4-[2-[3-[2-(4-aminophenyl)propan-2-yl]phenyl]propan-2-yl]aniline |
| InChI Key | KWOIWTRRPFHBSI-UHFFFAOYSA-N |
| Molecular Formula | C24H28N2 |
4-Triphenylmethylphenol 98.0+%, TCI America™
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CAS: 978-86-9 Molecular Formula: C25H20O Molecular Weight (g/mol): 336.43 MDL Number: MFCD00002364 InChI Key: NIPKXTKKYSKEON-UHFFFAOYSA-N Synonym: 4-triphenylmethylphenol,4-triphenylmethyl phenol,p-tritylphenol,p-triphenylmethylphenol,phenol, 4-triphenylmethyl,p-cresol, .alpha.,.alpha.,.alpha.-triphenyl,4-tritylphenol,p-triphenylmethyl phenol,4-tri phenyl methyl phenol,phenol,4-triphenylmethyl PubChem CID: 70422 IUPAC Name: 4-(triphenylmethyl)phenol SMILES: OC1=CC=C(C=C1)C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 70422 |
|---|---|
| CAS | 978-86-9 |
| Molecular Weight (g/mol) | 336.43 |
| MDL Number | MFCD00002364 |
| SMILES | OC1=CC=C(C=C1)C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | 4-triphenylmethylphenol,4-triphenylmethyl phenol,p-tritylphenol,p-triphenylmethylphenol,phenol, 4-triphenylmethyl,p-cresol, .alpha.,.alpha.,.alpha.-triphenyl,4-tritylphenol,p-triphenylmethyl phenol,4-tri phenyl methyl phenol,phenol,4-triphenylmethyl |
| IUPAC Name | 4-(triphenylmethyl)phenol |
| InChI Key | NIPKXTKKYSKEON-UHFFFAOYSA-N |
| Molecular Formula | C25H20O |
5-Fluoro-2-nitrophenol 98.0+%, TCI America™
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CAS: 446-36-6 Molecular Formula: C6H4FNO3 Molecular Weight (g/mol): 157.1 MDL Number: MFCD00007107 InChI Key: QQURWFRNETXFTN-UHFFFAOYSA-N Synonym: 2-nitro-5-fluorophenol,3-fluoro-6-nitrophenol,phenol, 5-fluoro-2-nitro,4-fluoro-2-hydroxynitrobenzene,5-fluoro-2-nitro-phenol,pubchem1490,pubchem2371,acmc-209jzc,3-fluoro 6-nitrophenol,5-flouro-2-nitrophenol PubChem CID: 9937 IUPAC Name: 5-fluoro-2-nitrophenol SMILES: C1=CC(=C(C=C1F)O)[N+](=O)[O-]
| PubChem CID | 9937 |
|---|---|
| CAS | 446-36-6 |
| Molecular Weight (g/mol) | 157.1 |
| MDL Number | MFCD00007107 |
| SMILES | C1=CC(=C(C=C1F)O)[N+](=O)[O-] |
| Synonym | 2-nitro-5-fluorophenol,3-fluoro-6-nitrophenol,phenol, 5-fluoro-2-nitro,4-fluoro-2-hydroxynitrobenzene,5-fluoro-2-nitro-phenol,pubchem1490,pubchem2371,acmc-209jzc,3-fluoro 6-nitrophenol,5-flouro-2-nitrophenol |
| IUPAC Name | 5-fluoro-2-nitrophenol |
| InChI Key | QQURWFRNETXFTN-UHFFFAOYSA-N |
| Molecular Formula | C6H4FNO3 |
trans-Benzalacetone 98.0+%, TCI America™
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CAS: 1896-62-4 Molecular Formula: C10H10O Molecular Weight (g/mol): 146.189 MDL Number: MFCD00008779 InChI Key: BWHOZHOGCMHOBV-BQYQJAHWSA-N Synonym: benzalacetone,benzylideneacetone,methyl styryl ketone,4-phenylbut-3-en-2-one,acetocinnamone,4-phenyl-3-buten-2-one,e-4-phenylbut-3-en-2-one,benzylidene acetone,trans-benzalacetone,benzalaceton PubChem CID: 637759 ChEBI: CHEBI:78399 IUPAC Name: (E)-4-phenylbut-3-en-2-one SMILES: CC(=O)C=CC1=CC=CC=C1
| PubChem CID | 637759 |
|---|---|
| CAS | 1896-62-4 |
| Molecular Weight (g/mol) | 146.189 |
| ChEBI | CHEBI:78399 |
| MDL Number | MFCD00008779 |
| SMILES | CC(=O)C=CC1=CC=CC=C1 |
| Synonym | benzalacetone,benzylideneacetone,methyl styryl ketone,4-phenylbut-3-en-2-one,acetocinnamone,4-phenyl-3-buten-2-one,e-4-phenylbut-3-en-2-one,benzylidene acetone,trans-benzalacetone,benzalaceton |
| IUPAC Name | (E)-4-phenylbut-3-en-2-one |
| InChI Key | BWHOZHOGCMHOBV-BQYQJAHWSA-N |
| Molecular Formula | C10H10O |
2,3-Dichlorobenzyl Cyanide 98.0+%, TCI America™
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CAS: 3218-45-9 Molecular Formula: C8H5Cl2N Molecular Weight (g/mol): 186.04 MDL Number: MFCD01861392 InChI Key: CZLINJDTCHACEH-UHFFFAOYSA-N Synonym: 2,3-Dichlorophenylacetonitrile PubChem CID: 229020 IUPAC Name: 2-(2,3-dichlorophenyl)acetonitrile SMILES: ClC1=CC=CC(CC#N)=C1Cl
| PubChem CID | 229020 |
|---|---|
| CAS | 3218-45-9 |
| Molecular Weight (g/mol) | 186.04 |
| MDL Number | MFCD01861392 |
| SMILES | ClC1=CC=CC(CC#N)=C1Cl |
| Synonym | 2,3-Dichlorophenylacetonitrile |
| IUPAC Name | 2-(2,3-dichlorophenyl)acetonitrile |
| InChI Key | CZLINJDTCHACEH-UHFFFAOYSA-N |
| Molecular Formula | C8H5Cl2N |
Methyl Phenoxyacetate 99.0+%, TCI America™
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CAS: 2065-23-8 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00010227 InChI Key: BZCKRPHEZOHHBK-UHFFFAOYSA-N Synonym: methyl phenoxyacetate,phenoxyacetic acid methyl ester,acetic acid, phenoxy-, methyl ester,methylphenoxyacetate,unii-jd9of3328o,phenoxy methyl acetate,methyl phenoxy acetate,phenoxyacetic acid methyl,acetic acid, 2-phenoxy-, methyl ester,pubchem12489 PubChem CID: 16365 IUPAC Name: methyl 2-phenoxyacetate SMILES: COC(=O)COC1=CC=CC=C1
| PubChem CID | 16365 |
|---|---|
| CAS | 2065-23-8 |
| Molecular Weight (g/mol) | 166.176 |
| MDL Number | MFCD00010227 |
| SMILES | COC(=O)COC1=CC=CC=C1 |
| Synonym | methyl phenoxyacetate,phenoxyacetic acid methyl ester,acetic acid, phenoxy-, methyl ester,methylphenoxyacetate,unii-jd9of3328o,phenoxy methyl acetate,methyl phenoxy acetate,phenoxyacetic acid methyl,acetic acid, 2-phenoxy-, methyl ester,pubchem12489 |
| IUPAC Name | methyl 2-phenoxyacetate |
| InChI Key | BZCKRPHEZOHHBK-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
9-Bromo-7,7-dimethyl-7H-benzo[c]fluorene 98.0+%, TCI America™
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CAS: 1198396-46-1 Molecular Formula: C19H15Br Molecular Weight (g/mol): 323.23 MDL Number: MFCD27980277 InChI Key: SNUKBTHMZLUJKR-UHFFFAOYSA-N PubChem CID: 77231394 IUPAC Name: 9-bromo-7,7-dimethyl-7H-benzo[c]fluorene SMILES: CC1(C)C2=CC=C3C=CC=CC3=C2C2=C1C=C(Br)C=C2
| PubChem CID | 77231394 |
|---|---|
| CAS | 1198396-46-1 |
| Molecular Weight (g/mol) | 323.23 |
| MDL Number | MFCD27980277 |
| SMILES | CC1(C)C2=CC=C3C=CC=CC3=C2C2=C1C=C(Br)C=C2 |
| IUPAC Name | 9-bromo-7,7-dimethyl-7H-benzo[c]fluorene |
| InChI Key | SNUKBTHMZLUJKR-UHFFFAOYSA-N |
| Molecular Formula | C19H15Br |
4-Isothiocyanato-2-(trifluoromethyl)benzonitrile 98.0+%, TCI America™
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CAS: 143782-23-4 Molecular Formula: C9H3F3N2S Molecular Weight (g/mol): 228.192 MDL Number: MFCD09800709 InChI Key: TYXKOMAQTWRDCR-UHFFFAOYSA-N Synonym: 4-Cyano-3-(trifluoromethyl)phenyl Isothiocyanate, Isothiocyanic Acid 4-Cyano-3-(trifluoromethyl)phenyl Ester PubChem CID: 11615540 IUPAC Name: 4-isothiocyanato-2-(trifluoromethyl)benzonitrile SMILES: C1=CC(=C(C=C1N=C=S)C(F)(F)F)C#N
| PubChem CID | 11615540 |
|---|---|
| CAS | 143782-23-4 |
| Molecular Weight (g/mol) | 228.192 |
| MDL Number | MFCD09800709 |
| SMILES | C1=CC(=C(C=C1N=C=S)C(F)(F)F)C#N |
| Synonym | 4-Cyano-3-(trifluoromethyl)phenyl Isothiocyanate, Isothiocyanic Acid 4-Cyano-3-(trifluoromethyl)phenyl Ester |
| IUPAC Name | 4-isothiocyanato-2-(trifluoromethyl)benzonitrile |
| InChI Key | TYXKOMAQTWRDCR-UHFFFAOYSA-N |
| Molecular Formula | C9H3F3N2S |
2,5-Dibromoterephthalic Acid 98.0+%, TCI America™
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CAS: 13731-82-3 Molecular Formula: C8H4Br2O4 Molecular Weight (g/mol): 323.92 MDL Number: MFCD00204593 InChI Key: VUTICWRXMKBOSF-UHFFFAOYSA-N Synonym: 2,5-dibromoterephtalic acid,2,5-dibromobenzene-1,4-dicarboxylic acid,1,4-benzenedicarboxylic acid, 2,5-dibromo,pubchem14888,1, 2,5-dibromo,maybridge1_002153,2,5-dibromoterephtalicacid,2,5-dibromoterephthalicacid,acmc-1cb24,ksc174o0t PubChem CID: 83690 IUPAC Name: 2,5-dibromobenzene-1,4-dicarboxylic acid SMILES: OC(=O)C1=CC(Br)=C(C=C1Br)C(O)=O
| PubChem CID | 83690 |
|---|---|
| CAS | 13731-82-3 |
| Molecular Weight (g/mol) | 323.92 |
| MDL Number | MFCD00204593 |
| SMILES | OC(=O)C1=CC(Br)=C(C=C1Br)C(O)=O |
| Synonym | 2,5-dibromoterephtalic acid,2,5-dibromobenzene-1,4-dicarboxylic acid,1,4-benzenedicarboxylic acid, 2,5-dibromo,pubchem14888,1, 2,5-dibromo,maybridge1_002153,2,5-dibromoterephtalicacid,2,5-dibromoterephthalicacid,acmc-1cb24,ksc174o0t |
| IUPAC Name | 2,5-dibromobenzene-1,4-dicarboxylic acid |
| InChI Key | VUTICWRXMKBOSF-UHFFFAOYSA-N |
| Molecular Formula | C8H4Br2O4 |
1-Bromo-4-propylbenzene 97.0+%, TCI America™
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CAS: 588-93-2 Molecular Formula: C9H11Br Molecular Weight (g/mol): 199.091 MDL Number: MFCD00012456 InChI Key: NUPWGLKBGVNSJX-UHFFFAOYSA-N Synonym: 1-bromo-4-n-propylbenzene,4-bromo-n-propylbenzene,1-4'-bromophenyl propane,1-bromo-4-propyl-benzene,benzene, 1-bromo-4-propyl,4-propylbromobenzene,4-propyl bromobenzene,4-n-propylbromobenzene,4-propylphenyl bromide,pubchem10762 PubChem CID: 136374 IUPAC Name: 1-bromo-4-propylbenzene SMILES: CCCC1=CC=C(C=C1)Br
| PubChem CID | 136374 |
|---|---|
| CAS | 588-93-2 |
| Molecular Weight (g/mol) | 199.091 |
| MDL Number | MFCD00012456 |
| SMILES | CCCC1=CC=C(C=C1)Br |
| Synonym | 1-bromo-4-n-propylbenzene,4-bromo-n-propylbenzene,1-4'-bromophenyl propane,1-bromo-4-propyl-benzene,benzene, 1-bromo-4-propyl,4-propylbromobenzene,4-propyl bromobenzene,4-n-propylbromobenzene,4-propylphenyl bromide,pubchem10762 |
| IUPAC Name | 1-bromo-4-propylbenzene |
| InChI Key | NUPWGLKBGVNSJX-UHFFFAOYSA-N |
| Molecular Formula | C9H11Br |
5'-Iodo-m-terphenyl 98.0+%, TCI America™
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CAS: 87666-86-2 Molecular Formula: C18H13I Molecular Weight (g/mol): 356.206 MDL Number: MFCD26131291 InChI Key: LICOFADCKUKHJI-UHFFFAOYSA-N Synonym: 1-Iodo-3,5-diphenylbenzene, 5′C-Iodo-1,1′C:3′C,1′C′C-terphenyl PubChem CID: 13067230 IUPAC Name: 1-iodo-3,5-diphenylbenzene SMILES: C1=CC=C(C=C1)C2=CC(=CC(=C2)I)C3=CC=CC=C3
| PubChem CID | 13067230 |
|---|---|
| CAS | 87666-86-2 |
| Molecular Weight (g/mol) | 356.206 |
| MDL Number | MFCD26131291 |
| SMILES | C1=CC=C(C=C1)C2=CC(=CC(=C2)I)C3=CC=CC=C3 |
| Synonym | 1-Iodo-3,5-diphenylbenzene, 5′C-Iodo-1,1′C:3′C,1′C′C-terphenyl |
| IUPAC Name | 1-iodo-3,5-diphenylbenzene |
| InChI Key | LICOFADCKUKHJI-UHFFFAOYSA-N |
| Molecular Formula | C18H13I |
4-Fluoro-2-(trifluoromethyl)benzaldehyde 98.0+%, TCI America™
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CAS: 90176-80-0 Molecular Formula: C8H4F4O Molecular Weight (g/mol): 192.113 InChI Key: NONOHEMDNFTKCZ-UHFFFAOYSA-N Synonym: 4-fluoro-2-trifluoromethyl benzaldehyde,2-trifluoromethyl-4-fluorobenzaldehyde,4-fluoro-2-trifluoromethyl-benzaldehyde,benzaldehyde, 4-fluoro-2-trifluoromethyl,5-fluoro-2-formylbenzotrifluoride,alpha,alpha,alpha,4-tetrafluoro-o-tolualdehyde,pubchem4241,ksc487q2t,paragos 530044 PubChem CID: 522940 IUPAC Name: 4-fluoro-2-(trifluoromethyl)benzaldehyde SMILES: C1=CC(=C(C=C1F)C(F)(F)F)C=O
| PubChem CID | 522940 |
|---|---|
| CAS | 90176-80-0 |
| Molecular Weight (g/mol) | 192.113 |
| SMILES | C1=CC(=C(C=C1F)C(F)(F)F)C=O |
| Synonym | 4-fluoro-2-trifluoromethyl benzaldehyde,2-trifluoromethyl-4-fluorobenzaldehyde,4-fluoro-2-trifluoromethyl-benzaldehyde,benzaldehyde, 4-fluoro-2-trifluoromethyl,5-fluoro-2-formylbenzotrifluoride,alpha,alpha,alpha,4-tetrafluoro-o-tolualdehyde,pubchem4241,ksc487q2t,paragos 530044 |
| IUPAC Name | 4-fluoro-2-(trifluoromethyl)benzaldehyde |
| InChI Key | NONOHEMDNFTKCZ-UHFFFAOYSA-N |
| Molecular Formula | C8H4F4O |