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Substance Name: 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-(3-methylbutyl)-, 1-oxide
RN: 80479-43-2
InChIKey: PQNFAOARTLLUMC-UHFFFAOYSA-N

Molecular Formula

  • C9-H17-O4-P

Molecular Weight

  • 220.2033
 
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Names and Synonyms

Synonyms

  • 1,3-Propanediol, 2-(hydroxymethyl)-2-(isopentyl)-, cyclic phosphate (1:1)
  • 4-(3-Methylbutyl)-2,6,7-trioxa-1-phosphabicyclo(2.2.2)octane 1-oxide

Systematic Name

  • 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-(3-methylbutyl)-, 1-oxide

Registry Numbers

CAS Registry Number

  • 80479-43-2

System Generated Number

  • 0080479432

Structure Descriptors

InChI

1S/C9H17O4P/c1-8(2)3-4-9-5-11-14(10,12-6-9)13-7-9/h8H,3-7H2,1-2H3

InChIKey

PQNFAOARTLLUMC-UHFFFAOYSA-N

Smiles

CC(C)CCC12COP(=O)(OC1)OC2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 11250ug/kg (11.25mg/kg)   Nippon Noyaku Gakkaishi. Journal of the Pesticide Science Society of Japan. Vol. 8, Pg. 601, 1983.