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Substance Name: 1,3-Propanediol, 2-cyclohexyl-2-methyl-, dicarbamate
RN: 1146-18-5
InChIKey: BXDCHFVFANYXKP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H22-N2-O4

Molecular Weight

  • 258.316
 
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Names and Synonyms

Synonyms

  • 2-Cyclohexyl-2-methyl-1,3-propanediol dicarbamate
  • BRN 1985064

Systematic Name

  • 1,3-Propanediol, 2-cyclohexyl-2-methyl-, dicarbamate

Registry Numbers

CAS Registry Number

  • 1146-18-5

System Generated Number

  • 0001146185

Structure Descriptors

InChI

1S/C12H22N2O4/c1-12(7-17-10(13)15,8-18-11(14)16)9-5-3-2-4-6-9/h9H,2-8H2,1H3,(H2,13,15)(H2,14,16)

InChIKey

BXDCHFVFANYXKP-UHFFFAOYSA-N

Smiles

C1CCCC(C1)C(COC(N)=O)(COC(N)=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 420mg/kg (420mg/kg) AUTONOMIC NERVOUS SYSTEM: "SMOOTH MUSCLE RELAXANT (MECHANISM UNDEFINED, SPASMOLYTIC)" Journal of Medicinal Chemistry. Vol. 12, Pg. 462, 1969.
rabbit LDLo intravenous 150mg/kg (150mg/kg)   Farmaco, Edizione Scientifica. Vol. 18, Pg. 780, 1963.