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Substance Name: 1,3-Propanediol, 2-pentyl-
RN: 25462-23-1
InChIKey: RHYUFGNCUXTFTC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H18-O2

Molecular Weight

  • 146.228
 
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Names and Synonyms

Synonyms

  • 2-Pentyl-1,3-propanediol
  • BRN 1847383

Systematic Name

  • 1,3-Propanediol, 2-pentyl-

Registry Numbers

CAS Registry Number

  • 25462-23-1

System Generated Number

  • 0025462231

Structure Descriptors

InChI

1S/C8H18O2/c1-2-3-4-5-8(6-9)7-10/h8-10H,2-7H2,1H3

InChIKey

RHYUFGNCUXTFTC-UHFFFAOYSA-N

Smiles

C(CO)(CO)CCCCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 360mg/kg (360mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 462, 1969.