91076-94-7
| Name | ETHYL 3-AMINO-5-(4-CHLOROPHENYL)THIOPHE& |
| CAS | 91076-94-7 |
| Molecular Formula | C13H12ClNO2S |
| MDL Number | MFCD06336766 |
| Molecular Weight | 281.76 |
| MOL File | 91076-94-7.mol |
Chemical Properties
| Melting point | 107-111 °C (lit.) |
| Boiling point | 472.8±45.0 °C(Predicted) |
| density | 1.323±0.06 g/cm3(Predicted) |
| storage temp. | 2-8°C, protect from light |
| form | solid |
| pka | 1.53±0.10(Predicted) |
| Appearance | Brown to black Solid |
| InChI | 1S/C13H12ClNO2S/c1-2-17-13(16)12-10(15)7-11(18-12)8-3-5-9(14)6-4-8/h3-7H,2,15H2,1H3 |
| InChIKey | VOIKQRXCKXHXNF-UHFFFAOYSA-N |
| SMILES | CCOC(=O)c1sc(cc1N)-c2ccc(Cl)cc2 |
Safety Data
| Hazard Codes | Xi |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| Storage Class | 13 - Non Combustible Solids |
| Hazard Classifications | Aquatic Chronic 4 Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |