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Substance Name: Febarbamate [INN:DCF]
RN: 13246-02-1
UNII: 5Z48ONN38P
InChIKey: QHZQILHUJDRDAI-UHFFFAOYSA-N

Molecular Formula

  • C20-H27-N3-O6

Molecular Weight

  • 405.4483
 
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Names and Synonyms

Name of Substance

  • Febarbamate
  • Febarbamate [INN:DCF]

Synonyms

  • 1-(3-Butoxy-2-hydroxypropyl)-5-ethyl-5-phenylbarbituric acid, carbamate ester
  • 3-(3-Butoxy-3-carbamoyloxypropyl)-5-ethyl-5-phenylbarbituric acid
  • 3-(gamma-Butoxy-beta-carbamyl-beta-propanol)-5-phenyl-5-ethylmalonylurea
  • 5-24-09-00304 (Beilstein Handbook Reference)
  • BRN 0591584
  • Carbamic acid, ester with 1-(3-butoxy-2-hydroxypropyl)-5-ethyl-5-phenylbarbituric acid
  • EINECS 236-226-3
  • Febarbamate
  • Febarbamato
  • Febarbamato [INN-Spanish]
  • Febarbamatum
  • Febarbamatum [INN-Latin]
  • G-Tril
  • Getril
  • GO 560
  • Go-560
  • Phebarbamate
  • Phenobamate
  • Solium
  • Tymium
  • UNII-5Z48ONN38P

Systematic Names

  • 1-(3-Butoxy-2-hydroxypropyl)-5-ethyl-5-phenylbarbituric acid carbamate ester
  • Barbituric acid, 1-(3-butoxy-2-hydroxypropyl)-5-ethyl-5-phenyl-, carbamate (ester)
  • Febarbamate

Registry Numbers

CAS Registry Number

  • 13246-02-1

FDA UNII

  • 5Z48ONN38P

System Generated Number

  • 0013246021

Structure Descriptors

InChI

1S/C20H27N3O6/c1-3-5-11-28-13-15(29-18(21)26)12-23-17(25)20(4-2,16(24)22-19(23)27)14-9-7-6-8-10-14/h6-10,15H,3-5,11-13H2,1-2H3,(H2,21,26)(H,22,24,27)

InChIKey

QHZQILHUJDRDAI-UHFFFAOYSA-N

Smiles

CCCCOCC(CN1C(=O)NC(=O)C(CC)(C1=O)c2ccccc2)OC(=O)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1065mg/kg (1065mg/kg)   Helvetica Physiologia et Pharmacologica Acta. Vol. 19, Pg. 241, 1961.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.820 (none)   EST
Atmospheric OH Rate Constant 5.10E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.