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Substance Name: Pyrimidine, 2-amino-4-methyl-
RN: 108-52-1
InChIKey: GHCFWKFREBNSPC-UHFFFAOYSA-N

Molecular Formula

  • C5-H7-N3

Molecular Weight

  • 109.131
 
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Names and Synonyms

Synonyms

  • 2-Amino-4-methylpyrimidine
  • 5-25-10-00160 (Beilstein Handbook Reference)
  • 6-Methyl-2-pyrimidinamine
  • AI3-08091
  • BRN 0108506
  • EINECS 203-591-5
  • NSC 1939

Systematic Names

  • 2-Pyrimidinamine, 4-methyl- (9CI)
  • 4-Methylpyrimidin-2-ylamine
  • Pyrimidine, 2-amino-4-methyl-

Registry Numbers

CAS Registry Number

  • 108-52-1

System Generated Number

  • 0000108521

Structure Descriptors

InChI

1S/C5H7N3/c1-4-2-3-7-5(6)8-4/h2-3H,1H3,(H2,6,7,8)

InChIKey

GHCFWKFREBNSPC-UHFFFAOYSA-N

Smiles

n1c(ccnc1N)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intravenous 730mg/kg (730mg/kg)   Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 211, Pg. 367, 1950.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 160.3 deg C   EXP
pKa Dissociation Constant 4.11 (none) 20 EXP
log P (octanol-water) 0.430 (none)   EST
Water Solubility 4.73E+04 mg/L 25 EST
Vapor Pressure 0.069 mm Hg 25 EST
Henry's Law Constant 4.04E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.33E-11 cm3/molecule-sec 25 EST

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