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| IUPAC Name: | 4-(dimethylamino)benzonitrile |
| Description: | 4-(Dimethylamino)benzonitrile (CAS# 1197-19-9) is used in predicting the carcinogenicity of aromatic amine derivative in UK EMS collaborative study. |
| Molecular Weight: | 146.19 |
| Molecular Formula: | C9H10N2 |
| Canonical SMILES: | CN(C)C1=CC=C(C=C1)C#N |
| InChI: | InChI=1S/C9H10N2/c1-11(2)9-5-3-8(7-10)4-6-9/h3-6H,1-2H3 |
| InChI Key: | JYMNQRQQBJIMCV-UHFFFAOYSA-N |
| Boiling Point: | 318-318 °C |
| Melting Point: | 70-76 °C |
| Purity: | 95 % |
| Density: | 1.04 g/cm3 |
| Solubility: | Other solvents(Soluble) : Methanol |
| Appearance: | Light brown crystalline powder |
| Storage: | Sealed in dry, Room Temperature |
| MDL: | MFCD00001815 |
| LogP: | 1.62428 |
| Vapor Pressure: | 0.02 [mmHg] |
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[(2,3-Difluorophenyl)methyl][(1,3-dimethylpyrazol-4-yl)methyl]amine
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