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Substance Name: 1,3-Propanediol, 2-ethyl-2-pentyl-
RN: 25450-93-5
InChIKey: FKXLOGLAYTUOFK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H22-O2

Molecular Weight

  • 174.282
 
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Names and Synonyms

Synonyms

  • 2-Ethyl-2-pentyl-1,3-propanediol
  • BRN 1848188

Systematic Name

  • 1,3-Propanediol, 2-ethyl-2-pentyl-

Registry Numbers

CAS Registry Number

  • 25450-93-5

System Generated Number

  • 0025450935

Structure Descriptors

InChI

1S/C10H22O2/c1-3-5-6-7-10(4-2,8-11)9-12/h11-12H,3-9H2,1-2H3

InChIKey

FKXLOGLAYTUOFK-UHFFFAOYSA-N

Smiles

C(C(CO)(CCCCC)CC)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 280mg/kg (280mg/kg) AUTONOMIC NERVOUS SYSTEM: "SMOOTH MUSCLE RELAXANT (MECHANISM UNDEFINED, SPASMOLYTIC)" Journal of Medicinal Chemistry. Vol. 12, Pg. 462, 1969.