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Substance Name: Barbituric acid, 5-butyl-5-(1-methyl-1-propenyl)-
RN: 67050-50-4
InChIKey: HCIVICGGJAIDCU-VMPITWQZSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H17-N2-O3

Molecular Weight

  • 238.2852
 
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Names and Synonyms

Synonym

  • 5-Butyl-5-(1-methyl-1-propenyl)barbituric acid

Systematic Name

  • Barbituric acid, 5-butyl-5-(1-methyl-1-propenyl)-

Registry Numbers

CAS Registry Number

  • 67050-50-4

System Generated Number

  • 0067050504

Structure Descriptors

InChI

1S/C12H18N2O3/c1-4-6-7-12(8(3)5-2)9(15)13-11(17)14-10(12)16/h5H,4,6-7H2,1-3H3,(H2,13,14,15,16,17)/b8-5+

InChIKey

HCIVICGGJAIDCU-VMPITWQZSA-N

Smiles

CCCCC1(\C(=C\C)\C)C(=O)NC(=O)NC1=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 330mg/kg (330mg/kg)   Journal of the American Chemical Society. Vol. 61, Pg. 353, 1939.
mouse LD50 oral 600mg/kg (600mg/kg)   Journal of the American Chemical Society. Vol. 61, Pg. 353, 1939.