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Substance Name: 1,2-Propanediol, 3-(m-ethylphenoxy)-
RN: 64049-52-1
InChIKey: JCLWQYMAWWJMSX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H16-O3

Molecular Weight

  • 196.244
 
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Names and Synonyms

Synonyms

  • 3-(m-Ethylphenoxy)-1,2-propanediol
  • 4-06-00-03017 (Beilstein Handbook Reference)
  • BRN 3253379

Systematic Name

  • 1,2-Propanediol, 3-(m-ethylphenoxy)-

Registry Numbers

CAS Registry Number

  • 64049-52-1

System Generated Number

  • 0064049521

Structure Descriptors

InChI

1S/C11H16O3/c1-2-9-4-3-5-11(6-9)14-8-10(13)7-12/h3-6,10,12-13H,2,7-8H2,1H3

InChIKey

JCLWQYMAWWJMSX-UHFFFAOYSA-N

Smiles

O(c1cc(CC)ccc1)C[C@@H](O)CO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 480mg/kg (480mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 72, Pg. 1545, 1952.