5-Phenoxy-1,4,5,6-Tetrahydropyrimidine

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Properties Simple | Detailed

Formula C10H12N2O
IUPAC Name (5s)-5-phenoxy-1,4,5,6-tetrahydropyrimidine
Molecular Mass 176.215 g·mol−1
Heat of Formation 24.5 ± 16.7 kJ·mol−1
Dipole Moment 2.82 ± 1.08 D
Volume 218.12 Å 3
Surface Area 208.3 Å 2
HOMO Energy -9.11 ± 0.55 eV
LUMO Energy 0.08 ± eV
Point Group Symmetry C1
Synonyms
  • 1,4,5,6-tetrahydro-5-phenoxypyrimidine
  • 5-(phenoxy)-1,4,5,6-tetrahydropyrimidine
  • ah6405
  • pyrimidine, 1,4,5,6-tetrahydro-5-phenoxy-
CAS Number(s)
  • 31822-84-1
InChIKey OIGIQMJAAZXDQH-UHFFFAOYSA-N
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