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Substance Name: 1H-Purine-2,6-dione, 3,7-dihydro-1-methyl-7-(2-methylpropyl)-
RN: 137235-84-8
InChIKey: VCBURIAVUSLZHM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H14-N4-O2

Molecular Weight

  • 222.2466
 
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Names and Synonyms

Synonyms

  • 1-Methyl-7-isobutylxanthine
  • 3,7-Dihydro-1-methyl-7-(2-methylpropyl)-1H-purine-2,6-dione

Systematic Name

  • 1H-Purine-2,6-dione, 3,7-dihydro-1-methyl-7-(2-methylpropyl)-

Registry Numbers

CAS Registry Number

  • 137235-84-8

System Generated Number

  • 0137235848

Structure Descriptors

InChI

1S/C10H14N4O2/c1-6(2)4-14-5-11-8-7(14)9(15)13(3)10(16)12-8/h5-6H,4H2,1-3H3,(H,12,16)

InChIKey

VCBURIAVUSLZHM-UHFFFAOYSA-N

Smiles

CC(C)Cn1cnc2c1c(=O)n(c(=O)[nH]2)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 303mg/kg (303mg/kg)   United States Patent Document. Vol. #5314890,