Ethyl 4-Methyl-2-(Methylsulfanyl)-5-Pyrimidinecarboxylate

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Properties Simple | Detailed

Formula C9H12N2O2S
IUPAC Name ethyl 4-methyl-2-methylsulfanyl-pyrimidine-5-carboxylate
Molecular Mass 212.269 g·mol−1
Heat of Formation -271.6 ± 16.7 kJ·mol−1
Dipole Moment 1.02 ± 1.08 D
Volume 248.81 Å 3
Surface Area 241.65 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy 1.85 ± eV
Point Group Symmetry Cs
Synonyms
  • 4-methyl-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester
  • 4-methyl-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester
  • 5-pyrimidinecarboxylic acid, 4-methyl-2-(methylthio)-, ethyl ester
  • emtmpc
  • ethyl 2-methylthio-4-5-pyrimidinecarboxylate
  • ethyl 4-methyl-2-methylsulfanylpyrimidine-5-carboxylate
  • ethyl-2-methylthio-4-methyl-5-pyrimidine carboxylate
  • s-7hna
InChIKey LJDJKDAPYUXBPE-UHFFFAOYSA-N
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