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Substance Name: Barbituric acid, 5-(2-isopentenyl)-5-isopropyl-1-methyl-
RN: 67051-27-8
InChIKey: HZKWVKRKHMKCIA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H20-N2-O3

Molecular Weight

  • 252.312
 
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Names and Synonyms

Synonyms

  • 4-24-00-02018 (Beilstein Handbook Reference)
  • 5-(2-Isopentenyl)-5-isopropyl-1-methylbarbituric acid
  • BRN 0234165

Systematic Name

  • Barbituric acid, 5-(2-isopentenyl)-5-isopropyl-1-methyl-

Registry Numbers

CAS Registry Number

  • 67051-27-8

System Generated Number

  • 0067051278

Structure Descriptors

InChI

1S/C13H20N2O3/c1-8(2)6-7-13(9(3)4)10(16)14-12(18)15(5)11(13)17/h6,9H,7H2,1-5H3,(H,14,16,18)

InChIKey

HZKWVKRKHMKCIA-UHFFFAOYSA-N

Smiles

CC(C)C1(CC=C(C)C)C(=O)NC(=O)N(C)C1=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 12mg/kg (12mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Journal of the American Chemical Society. Vol. 72, Pg. 4319, 1950.
mouse LD50 subcutaneous 70mg/kg (70mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Journal of the American Chemical Society. Vol. 72, Pg. 4319, 1950.
rabbit LD50 intravenous 5mg/kg (5mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Journal of the American Chemical Society. Vol. 72, Pg. 4319, 1950.