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Substance Name: 1,3-Propanediol, 2,2-diphenyl-, carbamate
RN: 25451-63-2
InChIKey: BXUSEVHVYZZWLZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H17-N-O3

Molecular Weight

  • 271.314
 
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Names and Synonyms

Synonyms

  • 2,2-Diphenyl-1,3-propanediol monocarbamate
  • 4-06-00-06721 (Beilstein Handbook Reference)
  • BRN 3348248
  • NSC 108721

Systematic Names

  • 1,3-Propanediol, 2,2-diphenyl-, carbamate
  • 1,3-Propanediol, 2,2-diphenyl-, monocarbamate (8CI)

Registry Numbers

CAS Registry Number

  • 25451-63-2

System Generated Number

  • 0025451632

Structure Descriptors

InChI

1S/C16H17NO3/c17-15(19)20-12-16(11-18,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,18H,11-12H2,(H2,17,19)

InChIKey

BXUSEVHVYZZWLZ-UHFFFAOYSA-N

Smiles

C(COC(=O)N)(c1ccccc1)(c1ccccc1)CO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1400mg/kg (1400mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 462, 1969.