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Substance Name: Pentaerythritol, cyclic phosphate (1:1) (8CI)
RN: 5301-78-0
InChIKey: YASRHLDAFCMIPB-UHFFFAOYSA-N

Molecular Formula

  • C5-H9-O5-P

Molecular Weight

  • 180.095
 
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Names and Synonyms

Synonyms

  • 4-Hydroxymethyl-2,6,7-trioxa-1-phosphabicyclo(2.2.2)octane-1-oxide
  • BRN 1951494
  • CN 1137
  • Pentaerythritol phosphate alcohol

Systematic Names

  • 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane-4-methanol, 1-oxide
  • Pentaerythritol, cyclic phosphate (1:1) (8CI)

Registry Numbers

CAS Registry Number

  • 5301-78-0

System Generated Number

  • 0005301780

Structure Descriptors

InChI

1S/C5H9O5P/c6-1-5-2-8-11(7,9-3-5)10-4-5/h6H,1-4H2

InChIKey

YASRHLDAFCMIPB-UHFFFAOYSA-N

Smiles

P12(OCC(CO1)(CO2)CO)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 500mg/kg (500mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Science. Vol. 182, Pg. 1135, 1973.