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4-Hydroperoxy cyclophosphamide Structure

4-Hydroperoxy cyclophosphamide

Chemical Properties

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 Information

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

Usage And Synthesis

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