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Substance Name: Barbituric acid, 5-isopropenyl-5-pentyl-
RN: 67051-36-9
InChIKey: BTBGGZFIDRCXTC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H18-N2-O3

Molecular Weight

  • 238.2852
 
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Names and Synonyms

Synonyms

  • 4-24-00-02013 (Beilstein Handbook Reference)
  • 5-Isopropenyl-5-pentylbarbituric acid
  • BRN 0225364

Systematic Name

  • Barbituric acid, 5-isopropenyl-5-pentyl-

Registry Numbers

CAS Registry Number

  • 67051-36-9

System Generated Number

  • 0067051369

Structure Descriptors

InChI

1S/C12H18N2O3/c1-4-5-6-7-12(8(2)3)9(15)13-11(17)14-10(12)16/h2,4-7H2,1,3H3,(H2,13,14,15,16,17)

InChIKey

BTBGGZFIDRCXTC-UHFFFAOYSA-N

Smiles

CCCCCC1(C(=C)C)C(=O)NC(=O)NC1=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 350mg/kg (350mg/kg)   Journal of the American Chemical Society. Vol. 61, Pg. 96, 1939.
mouse LD50 oral 470mg/kg (470mg/kg)   Journal of the American Chemical Society. Vol. 61, Pg. 96, 1939.