O,O-Diethyl Methylphosphonothioate

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Properties Simple | Detailed

Formula C5H13O2PS
IUPAC Name diethoxy-methyl-thioxo-λ5-phosphane
Molecular Mass 168.194 g·mol−1
Heat of Formation -645.0 ± 16.7 kJ·mol−1
Dipole Moment 3.21 ± 1.08 D
Volume 204.63 Å 3
Surface Area 204.24 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy 3.01 ± eV
Point Group Symmetry Cs
Synonyms
  • diethoxy-methyl-sulfanylidene-phosphorane
  • diethoxy-methyl-sulfanylidenephosphorane
  • diethoxy-methyl-thioxo-phosphorane
  • diethoxy-methyl-thioxophosphorane
  • diethyl methylphosphonothioate
  • o,o′-diethyl methylphosphonothioate
  • phosphonothioic acid, methyl-, o,o-diethyl ester
CAS Number(s)
  • 6996-81-2
InChIKey GEDUXIUTPVHAAV-UHFFFAOYSA-N
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