O-(4-Amino-3-Methylphenyl) O,O-Dimethyl Phosphorothioate

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Properties Simple | Detailed

Formula C9H14NO3PS
IUPAC Name 4-dimethoxyphosphinothioyloxy-2-methyl-aniline
Molecular Mass 247.251 g·mol−1
Heat of Formation -690.5 ± 16.7 kJ·mol−1
Dipole Moment 0.98 ± 1.08 D
Volume 284.86 Å 3
Surface Area 263.96 Å 2
HOMO Energy -7.97 ± 0.55 eV
LUMO Energy -0.51 ± eV
Point Group Symmetry C1
Synonyms
  • (4-dimethoxythiophosphoryloxy-2-methyl-phenyl)amine
  • 4-aminofenitrothion
  • 4-dimethoxyphosphinothioyloxy-2-methylaniline
  • aminofenitrothion
  • aminosumithion
  • fenitrothion amino analog
  • o,o-dimethyl-o-(3-methyl-4-aminophenyl) phosphorothioate
  • phosphorothioic acid, o-(4-amino-3-methylphenyl) o,o-dimethyl ester (9ci)
  • phosphorothioic acid, o-(4-amino-m-tolyl) o,o-dimethyl ester
CAS Number(s)
  • 13306-69-9
InChIKey MBJWTIDJKMSHDR-UHFFFAOYSA-N
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