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Substance Name: 1,3-Propanediol, 2-(1-methylbutyl)-, dicarbamate
RN: 25462-25-3
InChIKey: NPDPUYGJRPGBBN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H20-N2-O4

Molecular Weight

  • 232.278
 
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Names and Synonyms

Synonym

  • 2-(1-Methylbutyl)-1,3-propanediol dicarbamate

Systematic Name

  • 1,3-Propanediol, 2-(1-methylbutyl)-, dicarbamate

Registry Numbers

CAS Registry Number

  • 25462-25-3

System Generated Number

  • 0025462253

Structure Descriptors

InChI

1S/C10H20N2O4/c1-3-4-7(2)8(5-15-9(11)13)6-16-10(12)14/h7-8H,3-6H2,1-2H3,(H2,11,13)(H2,12,14)

InChIKey

NPDPUYGJRPGBBN-UHFFFAOYSA-N

Smiles

C(OCC(COC(=O)N)[C@@H](CCC)C)(=O)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1160mg/kg (1160mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 462, 1969.