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Substance Name: 9-Methyladenine
RN: 700-00-5
InChIKey: WRXCXOUDSPTXNX-UHFFFAOYSA-N

Molecular Formula

  • C6-H7-N5

Molecular Weight

  • 149.156
 
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Names and Synonyms

Name of Substance

  • 9-Methyladenine

Synonyms

  • 6-Amino-9-methylpurine
  • 9-Methyl-9H-adenine
  • 9-Methyladenine
  • CCRIS 6905
  • N9-Methyladenine
  • NSC 7843

Systematic Names

  • 9-Methyladenine
  • 9H-Purin-6-amine, 9-methyl- (9CI)
  • Adenine, 9-methyl- (8CI)

Registry Numbers

CAS Registry Number

  • 700-00-5

System Generated Number

  • 0000700005

Structure Descriptors

InChI

1S/C6H7N5/c1-11-3-10-4-5(7)8-2-9-6(4)11/h2-3H,1H3,(H2,7,8,9)

InChIKey

WRXCXOUDSPTXNX-UHFFFAOYSA-N

Smiles

c1nc2c(N)ncnc2n1C

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) -0.03 (none)   EXP
Water Solubility 3980 mg/L 25 EST
Vapor Pressure 5.57E-06 mm Hg 25 EST
Henry's Law Constant 1.50E-12 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.00E-10 cm3/molecule-sec 25 EST

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