101-79-1
| Name | 4-Amino-4'-chlorodiphenyl ether |
| CAS | 101-79-1 |
| EINECS(EC#) | 202-976-5 |
| Molecular Formula | C12H10ClNO |
| MDL Number | MFCD00043925 |
| Molecular Weight | 219.67 |
| MOL File | 101-79-1.mol |
Chemical Properties
| Appearance | Dark powder |
| Melting point | 99-103 °C |
| Boiling point | 205 °C / 12mmHg |
| density | 1.1764 (rough estimate) |
| refractive index | 1.6000 (estimate) |
| storage temp. | 2-8°C |
| solubility | DMSO (Slightly), Methanol (Slightly, Heated) |
| form | powder to crystal |
| pka | 4.60±0.10(Predicted) |
| color | White to Light yellow to Light orange |
| Water Solubility | Insoluble in water. |
| InChI | 1S/C12H10ClNO/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8H,14H2 |
| InChIKey | YTISFYMPVILQRL-UHFFFAOYSA-N |
| SMILES | Nc1ccc(Oc2ccc(Cl)cc2)cc1 |
| CAS DataBase Reference | 101-79-1(CAS DataBase Reference) |
| EPA Substance Registry System | 101-79-1(EPA Substance) |
Safety Data
| Hazard Codes | Xi,Xn |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| RTECS | BX1770000 |
| Hazard Note | Irritant |
| TSCA | Yes |
| HazardClass | IRRITANT |
| HS Code | 29222990 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Eye Dam. 1 Skin Irrit. 2 Skin Sens. 1 STOT SE 3 |
