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Substance Name: 9-Methyluric acid
RN: 55441-71-9
InChIKey: XJEJWDFDVPDMAS-UHFFFAOYSA-N

Molecular Formula

  • C6-H6-N4-O3

Molecular Weight

  • 182.1384
 
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Names and Synonyms

Name of Substance

  • 9-Methyluric acid

Synonym

  • EINECS 259-641-1

Systematic Name

  • 7,9-Dihydro-9-methyl-1H-purine-2,6,8(3H)-trione

Registry Numbers

CAS Registry Number

  • 55441-71-9

System Generated Number

  • 0055441719

Structure Descriptors

InChI

1S/C6H6N4O3/c1-10-3-2(7-6(10)13)4(11)9-5(12)8-3/h1H3,(H,7,13)(H2,8,9,11,12)

InChIKey

XJEJWDFDVPDMAS-UHFFFAOYSA-N

Smiles

[nH]1c(=O)[nH]c2n(C)c([nH]c2c1=O)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) -1.250 (none)   EST
Water Solubility 21 mg/L 25 EXP
Atmospheric OH Rate Constant 1.29E-11 cm3/molecule-sec 25 EST

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