39800-16-3
| Name | 4-HYDROPEROXY CYCLOPHOSPHAMIDE |
| CAS | 39800-16-3 |
| Molecular Formula | C7H15Cl2N2O4P |
| MDL Number | MFCD01710226 |
| Molecular Weight | 293.08 |
| MOL File | 39800-16-3.mol |
Chemical Properties
| Appearance | White Solid |
| Melting point | 100-103°C |
| Boiling point | 419.9±55.0 °C(Predicted) |
| density | 1.46±0.1 g/cm3(Predicted) |
| storage temp. | Hygroscopic, -86°C Freezer, Under Inert Atmosphere |
| solubility | Acetone (Slightly), Chloroform (Slightly), Methanol (Slightly), DCM |
| form | Solid |
| pka | 11.06±0.20(Predicted) |
| color | White to Pale Yellow |
| Stability: | Hygroscopic, Temperature Sensitive |
| InChI | InChI=1S/C7H16Cl2N2O4P/c8-2-4-11(5-3-9)16(13)10-7(15-12)1-6-14-16/h7,10,12,16H,1-6H2/q-1/p-1 |
| InChIKey | ZZENMHFAKYKQCX-UHFFFAOYSA-M |
| SMILES | [O-]OC1CCOP(N(CCCl)CCCl)([O-])N1 |
| CAS DataBase Reference | 39800-16-3 |
Safety Data
| Symbol(GHS) |   GHS07,GHS08 |
| Signal word | Warning |
| Hazard statements | H302-H341 |
| Precautionary statements | P201-P202-P264-P270-P280-P301+P312-P330-P308+P313-P405-P501 |
| WGK Germany | WGK 3 |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
| Hazard Classifications | Acute Tox. 3 Dermal Acute Tox. 3 Oral Carc. 1B Eye Dam. 1 Muta. 1B Repr. 1A Skin Corr. 1B Skin Sens. 1A |