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Substance Name: 1,3-Propanediol, 2-butyl-, dicarbamate
RN: 25451-12-1
InChIKey: XYVDBMJJKIAKIK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H18-N2-O4

Molecular Weight

  • 218.251
 
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Names and Synonyms

Synonym

  • 2-Butyl-1,3-propanediol dicarbamate

Systematic Name

  • 1,3-Propanediol, 2-butyl-, dicarbamate

Registry Numbers

CAS Registry Number

  • 25451-12-1

System Generated Number

  • 0025451121

Structure Descriptors

InChI

1S/C9H18N2O4/c1-2-3-4-7(5-14-8(10)12)6-15-9(11)13/h7H,2-6H2,1H3,(H2,10,12)(H2,11,13)

InChIKey

XYVDBMJJKIAKIK-UHFFFAOYSA-N

Smiles

C(=O)(OCC(COC(=O)N)CCCC)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1920mg/kg (1920mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 462, 1969.