4-[(2-Cyanoethyl)methylamino]benzaldehyde
- Product Name4-[(2-Cyanoethyl)methylamino]benzaldehyde
- CAS94-21-3
- MFC11H12N2O
- MW188.23
- EINECS202-315-0
- MOL File94-21-3.mol
Chemical Properties
| Melting point | 70-74 °C (lit.) |
| Boiling point | 387.1±27.0 °C(Predicted) |
| Density | 1.137±0.06 g/cm3(Predicted) |
| storage temp. | under inert gas (nitrogen or Argon) at 2–8 °C |
| pka | 1.22±0.50(Predicted) |
| InChI | 1S/C11H12N2O/c1-13(8-2-7-12)11-5-3-10(9-14)4-6-11/h3-6,9H,2,8H2,1H3 |
| InChIKey | DNRTTXXWWAKULZ-UHFFFAOYSA-N |
| SMILES | CN(CCC#N)c1ccc(C=O)cc1 |
| CAS DataBase Reference | 94-21-3(CAS DataBase Reference) |
| EPA Substance Registry System | Propanenitrile, 3-[(4-formylphenyl)methylamino]- (94-21-3) |
Safety Information
| Hazard Codes | Xn |
| Risk Statements | 20/21/22-36/37/38 |
| Safety Statements | 26-36 |
| WGK Germany | 3 |
| TSCA | TSCA listed |
| HS Code | 2926907090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |