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Substance Name: 1,3-Propanediol, 2-isopropyl-2-methyl-, carbamate, 2-propynylcarbamate
RN: 25384-98-9
InChIKey: OXZTXUBLTWIENJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H20-N2-O4

Molecular Weight

  • 256.3
 
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Names and Synonyms

Synonyms

  • 2-Isopropyl-2-methyl-1,3-propanediol carbamate 2-propynylcarbamate
  • BRN 3053716

Systematic Name

  • 1,3-Propanediol, 2-isopropyl-2-methyl-, carbamate, 2-propynylcarbamate

Registry Numbers

CAS Registry Number

  • 25384-98-9

System Generated Number

  • 0025384989

Structure Descriptors

InChI

1S/C12H20N2O4/c1-5-6-14-11(16)18-8-12(4,9(2)3)7-17-10(13)15/h1,9H,6-8H2,2-4H3,(H2,13,15)(H,14,16)

InChIKey

OXZTXUBLTWIENJ-UHFFFAOYSA-N

Smiles

C#CCNC(=O)OC[C@@](C(C)C)(C)COC(=O)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 530mg/kg (530mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 462, 1969.