Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1,3-Propanediol, 2-isobutyl-2-methyl-
RN: 25462-42-4
InChIKey: REQVMPVOKUHDOZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H18-O2

Molecular Weight

  • 146.228
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 2-Isobutyl-2-methyl-1,3-propanediol
  • BRN 1847385

Systematic Name

  • 1,3-Propanediol, 2-isobutyl-2-methyl-

Registry Numbers

CAS Registry Number

  • 25462-42-4

System Generated Number

  • 0025462424

Structure Descriptors

InChI

1S/C8H18O2/c1-7(2)4-8(3,5-9)6-10/h7,9-10H,4-6H2,1-3H3

InChIKey

REQVMPVOKUHDOZ-UHFFFAOYSA-N

Smiles

C(CC(C)C)(CO)(CO)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 780mg/kg (780mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 462, 1969.