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Substance Name: 1,3-Propanediol, 2-benzyl-, dicarbamate
RN: 25480-67-5
InChIKey: DAMWBEZPZUAGIM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H16-N2-O4

Molecular Weight

  • 252.268
 
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Names and Synonyms

Synonyms

  • 2-Benzyl-1,3-propanediol dicarbamate
  • BRN 2133115

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 25480-67-5

System Generated Number

  • 0025480675

Structure Descriptors

InChI

1S/C12H16N2O4/c13-11(15)17-7-10(8-18-12(14)16)6-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H2,13,15)(H2,14,16)

InChIKey

DAMWBEZPZUAGIM-UHFFFAOYSA-N

Smiles

C(C(COC(N)=O)Cc1ccccc1)OC(N)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 3200mg/kg (3200mg/kg) AUTONOMIC NERVOUS SYSTEM: "SMOOTH MUSCLE RELAXANT (MECHANISM UNDEFINED, SPASMOLYTIC)" Journal of Medicinal Chemistry. Vol. 12, Pg. 462, 1969.