Benzenoids
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2,7-Dinitrofluorene 97.0+%, TCI America™
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CAS: 5405-53-8 Molecular Formula: C13H8N2O4 Molecular Weight (g/mol): 256.217 MDL Number: MFCD00001121 InChI Key: IHZCVUBSTYOFSJ-UHFFFAOYSA-N PubChem CID: 21502 IUPAC Name: 2,7-dinitro-9H-fluorene SMILES: C1C2=C(C=CC(=C2)[N+](=O)[O-])C3=C1C=C(C=C3)[N+](=O)[O-]
| PubChem CID | 21502 |
|---|---|
| CAS | 5405-53-8 |
| Molecular Weight (g/mol) | 256.217 |
| MDL Number | MFCD00001121 |
| SMILES | C1C2=C(C=CC(=C2)[N+](=O)[O-])C3=C1C=C(C=C3)[N+](=O)[O-] |
| IUPAC Name | 2,7-dinitro-9H-fluorene |
| InChI Key | IHZCVUBSTYOFSJ-UHFFFAOYSA-N |
| Molecular Formula | C13H8N2O4 |
3-Acetoxybenzaldehyde 98.0+%, TCI America™
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CAS: 34231-78-2 Molecular Formula: C9H8O3 Molecular Weight (g/mol): 164.16 MDL Number: MFCD00016603 InChI Key: GVUMZPWBUAGJBP-UHFFFAOYSA-N Synonym: 3-acetoxybenzaldehyde,benzaldehyde, 3-acetyloxy,acetoxybenzaldehyde,acetic acid 3-formylphenyl ester,m-acetoxybenzaldehyde,m-ace-toxybenzaldehyde,meta-acetoxybenzaldehyde,pubchem13227,3-formylphenyl acetate PubChem CID: 118618 IUPAC Name: (3-formylphenyl) acetate SMILES: CC(=O)OC1=CC=CC(=C1)C=O
| PubChem CID | 118618 |
|---|---|
| CAS | 34231-78-2 |
| Molecular Weight (g/mol) | 164.16 |
| MDL Number | MFCD00016603 |
| SMILES | CC(=O)OC1=CC=CC(=C1)C=O |
| Synonym | 3-acetoxybenzaldehyde,benzaldehyde, 3-acetyloxy,acetoxybenzaldehyde,acetic acid 3-formylphenyl ester,m-acetoxybenzaldehyde,m-ace-toxybenzaldehyde,meta-acetoxybenzaldehyde,pubchem13227,3-formylphenyl acetate |
| IUPAC Name | (3-formylphenyl) acetate |
| InChI Key | GVUMZPWBUAGJBP-UHFFFAOYSA-N |
| Molecular Formula | C9H8O3 |
2-(Trifluoromethyl)benzenesulfonyl Chloride 98.0+%, TCI America™
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CAS: 776-04-5 Molecular Formula: C7H4ClF3O2S Molecular Weight (g/mol): 244.612 InChI Key: ZIZGWNOAHUCACM-UHFFFAOYSA-N Synonym: 2-trifluoromethyl benzenesulfonyl chloride,2-trifluoromethyl benzene-1-sulfonyl chloride,2-trifluoromethylbenzenesulphonyl chloride,2-trifluoromethyl benzenesulphonyl chloride,o-trifluoromethyl benzenesulfonyl chloride,o-trifluoromethylbenzenesulfonyl chloride,2-trifluoromethyl benzene sulfonyl chloride,benzenesulfonyl chloride, 2-trifluoromethyl,alpha,alpha,alpha-trifluorotoluene-2-sulfonyl chloride PubChem CID: 136616 IUPAC Name: 2-(trifluoromethyl)benzenesulfonyl chloride SMILES: C1=CC=C(C(=C1)C(F)(F)F)S(=O)(=O)Cl
| PubChem CID | 136616 |
|---|---|
| CAS | 776-04-5 |
| Molecular Weight (g/mol) | 244.612 |
| SMILES | C1=CC=C(C(=C1)C(F)(F)F)S(=O)(=O)Cl |
| Synonym | 2-trifluoromethyl benzenesulfonyl chloride,2-trifluoromethyl benzene-1-sulfonyl chloride,2-trifluoromethylbenzenesulphonyl chloride,2-trifluoromethyl benzenesulphonyl chloride,o-trifluoromethyl benzenesulfonyl chloride,o-trifluoromethylbenzenesulfonyl chloride,2-trifluoromethyl benzene sulfonyl chloride,benzenesulfonyl chloride, 2-trifluoromethyl,alpha,alpha,alpha-trifluorotoluene-2-sulfonyl chloride |
| IUPAC Name | 2-(trifluoromethyl)benzenesulfonyl chloride |
| InChI Key | ZIZGWNOAHUCACM-UHFFFAOYSA-N |
| Molecular Formula | C7H4ClF3O2S |
4-Amino-3-bromobenzotrifluoride 98.0+%, TCI America™
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CAS: 57946-63-1 Molecular Formula: C7H5BrF3N Molecular Weight (g/mol): 240.02 MDL Number: MFCD00042150 InChI Key: QKRJIXSZTKOFTD-UHFFFAOYSA-N Synonym: 2-bromo-4-trifluoromethyl aniline,4-amino-3-bromobenzotrifluoride,2-bromo-4-trifluoromethyl-phenylamine,benzenamine, 2-bromo-4-trifluoromethyl,3-bromo-4-aminobenzotrifluoride,4-amino-3-bromo benzotrifluoride,buttpark 83\07-26,timtec-bb sbb000789,buttpark 44\03-51,2-bromo-4-trifluoromethyl phenylamine PubChem CID: 93899 IUPAC Name: 2-bromo-4-(trifluoromethyl)aniline SMILES: NC1=CC=C(C=C1Br)C(F)(F)F
| PubChem CID | 93899 |
|---|---|
| CAS | 57946-63-1 |
| Molecular Weight (g/mol) | 240.02 |
| MDL Number | MFCD00042150 |
| SMILES | NC1=CC=C(C=C1Br)C(F)(F)F |
| Synonym | 2-bromo-4-trifluoromethyl aniline,4-amino-3-bromobenzotrifluoride,2-bromo-4-trifluoromethyl-phenylamine,benzenamine, 2-bromo-4-trifluoromethyl,3-bromo-4-aminobenzotrifluoride,4-amino-3-bromo benzotrifluoride,buttpark 83\07-26,timtec-bb sbb000789,buttpark 44\03-51,2-bromo-4-trifluoromethyl phenylamine |
| IUPAC Name | 2-bromo-4-(trifluoromethyl)aniline |
| InChI Key | QKRJIXSZTKOFTD-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrF3N |
2-Bromo-4-fluorobenzaldehyde 98.0+%, TCI America™
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CAS: 59142-68-6 Molecular Formula: C7H4BrFO Molecular Weight (g/mol): 203.01 MDL Number: MFCD00672923 InChI Key: OPZDXMCOWFPQPE-UHFFFAOYSA-N PubChem CID: 2773319 IUPAC Name: 2-bromo-4-fluorobenzaldehyde SMILES: FC1=CC(Br)=C(C=O)C=C1
| PubChem CID | 2773319 |
|---|---|
| CAS | 59142-68-6 |
| Molecular Weight (g/mol) | 203.01 |
| MDL Number | MFCD00672923 |
| SMILES | FC1=CC(Br)=C(C=O)C=C1 |
| IUPAC Name | 2-bromo-4-fluorobenzaldehyde |
| InChI Key | OPZDXMCOWFPQPE-UHFFFAOYSA-N |
| Molecular Formula | C7H4BrFO |
Benzyl 3-Bromopropyl Ether 95.0+%, TCI America™
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CAS: 54314-84-0 Molecular Formula: C10H13BrO Molecular Weight (g/mol): 229.12 MDL Number: MFCD00134570 InChI Key: PSUXTZLDBVEZTD-UHFFFAOYSA-N Synonym: benzyl 3-bromopropyl ether,3-bromopropoxy methyl benzene,3-bromopropylbenzyl ether,3-benzyloxy-1-bromopropane,3-benzyloxy propyl bromide,benzene, 3-bromopropoxy methyl,1-3-bromopropoxy methyl benzene,benzyl3-bromopropylether PubChem CID: 2776064 IUPAC Name: [(3-bromopropoxy)methyl]benzene SMILES: BrCCCOCC1=CC=CC=C1
| PubChem CID | 2776064 |
|---|---|
| CAS | 54314-84-0 |
| Molecular Weight (g/mol) | 229.12 |
| MDL Number | MFCD00134570 |
| SMILES | BrCCCOCC1=CC=CC=C1 |
| Synonym | benzyl 3-bromopropyl ether,3-bromopropoxy methyl benzene,3-bromopropylbenzyl ether,3-benzyloxy-1-bromopropane,3-benzyloxy propyl bromide,benzene, 3-bromopropoxy methyl,1-3-bromopropoxy methyl benzene,benzyl3-bromopropylether |
| IUPAC Name | [(3-bromopropoxy)methyl]benzene |
| InChI Key | PSUXTZLDBVEZTD-UHFFFAOYSA-N |
| Molecular Formula | C10H13BrO |
2-(3-Bromophenyl)naphthalene 95.0+%, TCI America™
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CAS: 667940-23-0 Molecular Formula: C16H11Br Molecular Weight (g/mol): 283.17 MDL Number: MFCD16658911 InChI Key: FWPXWVYUNHYGPE-UHFFFAOYSA-N Synonym: 2-3-bromophenyl naphthalene,naphthalene, 2-3-bromophenyl,2 3-bromophenyl naphthalene,ksc279g1j PubChem CID: 23080773 IUPAC Name: 2-(3-bromophenyl)naphthalene SMILES: BrC1=CC=CC(=C1)C1=CC2=CC=CC=C2C=C1
| PubChem CID | 23080773 |
|---|---|
| CAS | 667940-23-0 |
| Molecular Weight (g/mol) | 283.17 |
| MDL Number | MFCD16658911 |
| SMILES | BrC1=CC=CC(=C1)C1=CC2=CC=CC=C2C=C1 |
| Synonym | 2-3-bromophenyl naphthalene,naphthalene, 2-3-bromophenyl,2 3-bromophenyl naphthalene,ksc279g1j |
| IUPAC Name | 2-(3-bromophenyl)naphthalene |
| InChI Key | FWPXWVYUNHYGPE-UHFFFAOYSA-N |
| Molecular Formula | C16H11Br |
2-Cyanophenylacetonitrile 98.0+%, TCI America™
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CAS: 3759-28-2 Molecular Formula: C9H6N2 Molecular Weight (g/mol): 142.16 MDL Number: MFCD00001895 InChI Key: GKHSEDFDYXZGCG-UHFFFAOYSA-N Synonym: 2-cyanomethyl benzonitrile,homophthalonitrile,2-cyanobenzyl cyanide,2-cyanophenylacetonitrile,alpha-cyano-o-tolunitrile,o-cyanobenzyl cyanide,benzeneacetonitrile, 2-cyano,2-cyanobenzeneacetonitrile,o-cyanophenyl acetonitrile,o-tolunitrile, alpha-cyano PubChem CID: 77368 IUPAC Name: 2-(cyanomethyl)benzonitrile SMILES: N#CCC1=CC=CC=C1C#N
| PubChem CID | 77368 |
|---|---|
| CAS | 3759-28-2 |
| Molecular Weight (g/mol) | 142.16 |
| MDL Number | MFCD00001895 |
| SMILES | N#CCC1=CC=CC=C1C#N |
| Synonym | 2-cyanomethyl benzonitrile,homophthalonitrile,2-cyanobenzyl cyanide,2-cyanophenylacetonitrile,alpha-cyano-o-tolunitrile,o-cyanobenzyl cyanide,benzeneacetonitrile, 2-cyano,2-cyanobenzeneacetonitrile,o-cyanophenyl acetonitrile,o-tolunitrile, alpha-cyano |
| IUPAC Name | 2-(cyanomethyl)benzonitrile |
| InChI Key | GKHSEDFDYXZGCG-UHFFFAOYSA-N |
| Molecular Formula | C9H6N2 |
Leucoquinizarin 98.0+%, TCI America™
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CAS: 476-60-8 Molecular Formula: C14H10O4 Molecular Weight (g/mol): 242.23 MDL Number: MFCD00058948 InChI Key: BKNBVEKCHVXGPH-UHFFFAOYSA-N Synonym: 2,3-Dihydro-9,10-dihydroxy-1,4-anthraquinone, 1,4-Dihydroxyanthrahydroquinone, leuco-Quinizarin, 1,4,9,10-Tetrahydroxyanthracene PubChem CID: 68063 IUPAC Name: anthracene-1,4,9,10-tetrol SMILES: OC1=C2C(O)=C3C=CC=CC3=C(O)C2=C(O)C=C1
| PubChem CID | 68063 |
|---|---|
| CAS | 476-60-8 |
| Molecular Weight (g/mol) | 242.23 |
| MDL Number | MFCD00058948 |
| SMILES | OC1=C2C(O)=C3C=CC=CC3=C(O)C2=C(O)C=C1 |
| Synonym | 2,3-Dihydro-9,10-dihydroxy-1,4-anthraquinone, 1,4-Dihydroxyanthrahydroquinone, leuco-Quinizarin, 1,4,9,10-Tetrahydroxyanthracene |
| IUPAC Name | anthracene-1,4,9,10-tetrol |
| InChI Key | BKNBVEKCHVXGPH-UHFFFAOYSA-N |
| Molecular Formula | C14H10O4 |
Methyl 4-Bromo-3-hydroxybenzoate 98.0+%, TCI America™
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CAS: 106291-80-9 Molecular Formula: C8H7BrO3 Molecular Weight (g/mol): 231.05 MDL Number: MFCD08056372 InChI Key: VYOFPLOREOHCDP-UHFFFAOYSA-N Synonym: 4-Bromo-3-hydroxybenzoic Acid Methyl Ester PubChem CID: 6425184 IUPAC Name: methyl 4-bromo-3-hydroxybenzoate SMILES: COC(=O)C1=CC(O)=C(Br)C=C1
| PubChem CID | 6425184 |
|---|---|
| CAS | 106291-80-9 |
| Molecular Weight (g/mol) | 231.05 |
| MDL Number | MFCD08056372 |
| SMILES | COC(=O)C1=CC(O)=C(Br)C=C1 |
| Synonym | 4-Bromo-3-hydroxybenzoic Acid Methyl Ester |
| IUPAC Name | methyl 4-bromo-3-hydroxybenzoate |
| InChI Key | VYOFPLOREOHCDP-UHFFFAOYSA-N |
| Molecular Formula | C8H7BrO3 |
p-Tolyldiethanolamine 96.0+%, TCI America™
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CAS: 3077-12-1 Molecular Formula: C11H17NO2 Molecular Weight (g/mol): 195.26 MDL Number: MFCD00020580 InChI Key: JUVSRZCUMWZBFK-UHFFFAOYSA-N Synonym: N,N-Bis(2-hydroxyethyl)-p-toluidine, 2,2′C-(4-Methylphenylimino)diethanol, 2,2′C-(p-Tolylimino)diethanol PubChem CID: 76497 IUPAC Name: 2-[N-(2-hydroxyethyl)-4-methylanilino]ethanol SMILES: CC1=CC=C(C=C1)N(CCO)CCO
| PubChem CID | 76497 |
|---|---|
| CAS | 3077-12-1 |
| Molecular Weight (g/mol) | 195.26 |
| MDL Number | MFCD00020580 |
| SMILES | CC1=CC=C(C=C1)N(CCO)CCO |
| Synonym | N,N-Bis(2-hydroxyethyl)-p-toluidine, 2,2′C-(4-Methylphenylimino)diethanol, 2,2′C-(p-Tolylimino)diethanol |
| IUPAC Name | 2-[N-(2-hydroxyethyl)-4-methylanilino]ethanol |
| InChI Key | JUVSRZCUMWZBFK-UHFFFAOYSA-N |
| Molecular Formula | C11H17NO2 |
(S)-4-Benzyloxy-1,2-butanediol 95.0+%, TCI America™
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CAS: 69985-32-6 Molecular Formula: C11H16O3 Molecular Weight (g/mol): 196.25 MDL Number: MFCD10000950 InChI Key: TVRPDIKPMQUOSL-UHFFFAOYNA-N PubChem CID: 9794180 IUPAC Name: 4-(benzyloxy)butane-1,2-diol SMILES: OCC(O)CCOCC1=CC=CC=C1
| PubChem CID | 9794180 |
|---|---|
| CAS | 69985-32-6 |
| Molecular Weight (g/mol) | 196.25 |
| MDL Number | MFCD10000950 |
| SMILES | OCC(O)CCOCC1=CC=CC=C1 |
| IUPAC Name | 4-(benzyloxy)butane-1,2-diol |
| InChI Key | TVRPDIKPMQUOSL-UHFFFAOYNA-N |
| Molecular Formula | C11H16O3 |
4-Phenoxyphenylboronic Acid (contains varying amounts of Anhydride), TCI America™
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| PubChem CID | 2734377 |
|---|---|
| CAS | 51067-38-0 |
| MDL Number | MFCD00093312 |
| Physical Form | Crystalline Powder |
| TSCA | No |
| IUPAC Name | (4-phenoxyphenyl)boronic acid |
| InChI Key | KFXUHRXGLWUOJT-UHFFFAOYSA-N |
| Molecular Formula | C12H11BO3 |
| Formula Weight | 214.03 |
| Melting Point | 115°C |
4-Cyanobiphenyl 98.0+%, TCI America™
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CAS: 2920-38-9 Molecular Formula: C13H9N Molecular Weight (g/mol): 179.22 MDL Number: MFCD00001821 InChI Key: BPMBNLJJRKCCRT-UHFFFAOYSA-N Synonym: 4-cyanobiphenyl,1,1'-biphenyl-4-carbonitrile,4-biphenylcarbonitrile,p-phenylbenzonitrile,p-cyanobiphenyl,biphenyl-4-carbonitrile,4-phenylbenzenecarbonitrile,4-biphenylcarboxylic acid nitrile,4-cyanodiphenyl PubChem CID: 18021 IUPAC Name: [1,1'-biphenyl]-4-carbonitrile SMILES: N#CC1=CC=C(C=C1)C1=CC=CC=C1
| PubChem CID | 18021 |
|---|---|
| CAS | 2920-38-9 |
| Molecular Weight (g/mol) | 179.22 |
| MDL Number | MFCD00001821 |
| SMILES | N#CC1=CC=C(C=C1)C1=CC=CC=C1 |
| Synonym | 4-cyanobiphenyl,1,1'-biphenyl-4-carbonitrile,4-biphenylcarbonitrile,p-phenylbenzonitrile,p-cyanobiphenyl,biphenyl-4-carbonitrile,4-phenylbenzenecarbonitrile,4-biphenylcarboxylic acid nitrile,4-cyanodiphenyl |
| IUPAC Name | [1,1'-biphenyl]-4-carbonitrile |
| InChI Key | BPMBNLJJRKCCRT-UHFFFAOYSA-N |
| Molecular Formula | C13H9N |
2-Aminoterephthalic Acid 98.0+%, TCI America™
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CAS: 10312-55-7 Molecular Formula: C8H5NO4 Molecular Weight (g/mol): 179.13 MDL Number: MFCD00134536 InChI Key: GPNNOCMCNFXRAO-UHFFFAOYSA-L Synonym: aminoterephthalic acid,2-aminobenzene-1,4-dicarboxylic acid,2-amino-1,4-benzenedicarboxylic acid,4-carboxyanthranilic acid,1,4-benzenedicarboxylic acid, 2-amino,2-aminoterephthalic,aminoterephthalicacid,2,5-dicarboxyaniline,2-aminoterephtalic acid,timtec-bb sbb006751 PubChem CID: 2724822 IUPAC Name: 2-aminobenzene-1,4-dicarboxylate SMILES: NC1=CC(=CC=C1C([O-])=O)C([O-])=O
| PubChem CID | 2724822 |
|---|---|
| CAS | 10312-55-7 |
| Molecular Weight (g/mol) | 179.13 |
| MDL Number | MFCD00134536 |
| SMILES | NC1=CC(=CC=C1C([O-])=O)C([O-])=O |
| Synonym | aminoterephthalic acid,2-aminobenzene-1,4-dicarboxylic acid,2-amino-1,4-benzenedicarboxylic acid,4-carboxyanthranilic acid,1,4-benzenedicarboxylic acid, 2-amino,2-aminoterephthalic,aminoterephthalicacid,2,5-dicarboxyaniline,2-aminoterephtalic acid,timtec-bb sbb006751 |
| IUPAC Name | 2-aminobenzene-1,4-dicarboxylate |
| InChI Key | GPNNOCMCNFXRAO-UHFFFAOYSA-L |
| Molecular Formula | C8H5NO4 |