Chem
J-GLOBAL ID：200907083696106684   Nikkaji number：J329.076J

Thiophosphoric acid O,O-diethyl S-(2,6-dimethyl-4-oxoheptan-3-yl) ester

チオりん酸O,O-ジエチルS-(2,6-ジメチル-4-オキソヘプタン-3-イル)
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C13H27O4PS
Molecular formula furigana： C13-H27-O4-P-S
Molecular weight： 310.390
InChI： InChI=1S/C13H27O4PS/c1-7-16-18(15,17-8-2)19-13(11(5)6)12(14)9-10(3)4/h10-11,13H,7-9H2,1-6H3
InChI key： RLIUHRFDMNEHBH-UHFFFAOYSA-N
SMILES： CCOP(=O)(OCC)SC(C(C)C)C(=O)CC(C)C
Systematic name  (3)：
  • チオりん酸O,O-ジエチルS-(2,6-ジメチル-4-オキソヘプタン-3-イル)
  • ジエチル [(2,6-ジメチル-4-オキソヘプタン-3-イル)スルファニル]ホスホナート
  • diethyl [(2,6-dimethyl-4-oxoheptan-3-yl)sulfanyl]phosphonate
Other name (1)：
  • Thiophosphoric acid O,O-diethyl S-(2,6-dimethyl-4-oxoheptan-3-yl) ester
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