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Substance Name: 1,3-Propanediol, 2-methyl-2-propyl-, 2-methylallylcarbamate
RN: 25384-35-4
InChIKey: MMJRNJZURLUGLO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H23-N-O3

Molecular Weight

  • 229.318
 
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Names and Synonyms

Synonyms

  • 2-Methyl-2-propyl-1,3-propanediol 2-methylallylcarbamate
  • BRN 3049706

Systematic Name

  • 1,3-Propanediol, 2-methyl-2-propyl-, 2-methylallylcarbamate

Registry Numbers

CAS Registry Number

  • 25384-35-4

System Generated Number

  • 0025384354

Structure Descriptors

InChI

1S/C12H23NO3/c1-5-6-12(4,8-14)9-16-11(15)13-7-10(2)3/h14H,2,5-9H2,1,3-4H3,(H,13,15)

InChIKey

MMJRNJZURLUGLO-UHFFFAOYSA-N

Smiles

C(NCC(=C)C)(=O)OC[C@@](CO)(CCC)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 420mg/kg (420mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 462, 1969.