158401-52-6

Name 3-(2-chloroethyl)-2-oxo-2-hydroxy-1,3,6,2-oxadiazaphosphonane
CAS 158401-52-6
Molecular Formula C7H16ClN2O3P
Molecular Weight 242.64
MOL File 158401-52-6.mol
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Chemical Properties

Melting point  >190°C (dec.)
Boiling point  371.0±52.0 °C(Predicted)
density  1.33±0.1 g/cm3(Predicted)
storage temp.  Hygroscopic, -20°C Freezer, Under inert atmosphere
solubility  Water (Slightly)
form  Solid
pka 2.21±0.20(Predicted)
color  White to Off-White
Stability: Hygroscopic
Major Application pharmaceutical
InChI 1S/C7H16ClN2O3P/c8-2-5-10-6-4-9-3-1-7-13-14(10,11)12/h9H,1-7H2,(H,11,12)
InChIKey SIMWMEHPUXRDQD-UHFFFAOYSA-N
SMILES [P]1(=O)(N(CCNCCCO1)CCCl)O

Safety Data

WGK Germany  WGK 3
HS Code  2934990002
Storage Class 13 - Non Combustible Solids
Toxicity
mouse,LD50,intraperitoneal,1gm/kg (1000mg/kg),Journal of Medicinal Chemistry. Vol. 37, Pg. 3986, 1994.

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