Chemical Properties of PYRIMETHANIL (CAS 53112-28-0)

PYRIMETHANIL

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InChI
InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)
InChI Key
ZLIBICFPKPWGIZ-UHFFFAOYSA-N
Formula
C12H13N3
SMILES
Cc1cc(C)nc(Nc2ccccc2)n1
Molecular Weight1
199.25
CAS
53112-28-0
Other Names
  • 2-Pyrimidinamine, 4,6-dimethyl-N-phenyl-
  • 2-anilino-4,6-dimethylpyrimidine
  • 4,6-Dimethyl-N-phenyl-2-pyrimidinamine
  • 4,6-Dimethyl-N-phenyl-pyrimidin-2-amine
  • 4,6-dimethyl-N-phenylpyrimidin-2-amine
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Physical Properties

Property Value Unit Source
log10WS -3.76 Crippen Calculated Property
logPoct/wat 2.837 Crippen Calculated Property
McVol 162.360 ml/mol McGowan Calculated Property
Inp [1789.00; 1813.00]   Show Hide
Inp 1813.00 NIST
Inp 1789.00 NIST
Inp 1796.00 NIST
Inp 1801.00 NIST
Tfus 369.29 K Measure...

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
ΔfusH 21.23 kJ/mol 234.50 NIST

Similar Compounds

MEPANIPYRIM. 2-Pyrimidinamine, 4,6-dimethyl-N-trifluoroacetyl-N-phenyl-. N-(4,6-Dimethylpyrimidin-2-yl)-N-phenylacetamide. 2-Pyrimidinamine, 4,6-dimethyl-N-phenyl-N-trimethylsilyl-. Cyprodinil. 2-Pyrimidinamine, 4,6-dimethyl-N-pentafluoropropionyl-N-phenyl-. 4-Anilino-6-methyl-1,3,3a,7-tetrazaindene. 4-Cyclopropyl-6-methyl-N-phenyl-N-trifluoroacetyl-pyrimidin-2-amine. 4-Cyclopropyl-6-methyl-N-acetyl-N-phenylpyrimidin-2-amine. Sulfamethazine. 4-M-chloroanilino-6-methyl-1,3,3a,7-tetrazaindene. N,n'-bis-(4-(6-methyl)1,3,3a,7-tetrazaindenyl)-4,4'-biphenyldiamine. 4-P-bromoanilino-6-methyl-1,3,3a,7-tetrazaindene. Sulfamerazine. 4-P-methoxyanilino-6-methyl-1,3,3a,7-tetrazaindene.

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