Chem
J-GLOBAL ID：200907038475980090   Nikkaji number：J1.669.476B

[5-(5,5-Dimethyl-1,3-dioxane-2-yl)-1,3-phenylenebismethylene]bis(phosphonic acid diethyl) ester

[5-(5,5-ジメチル-1,3-ジオキサン-2-イル)-1,3-フェニレンビスメチレン]ビス(ホスホン酸ジエチル)
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： C22H38O8P2
Molecular formula furigana： C22-H38-O8-P2
Molecular weight： 492.486
InChI： InChI=1S/C22H38O8P2/c1-7-27-31(23,28-8-2)14-18-11-19(15-32(24,29-9-3)30-10-4)13-20(12-18)21-25-16-22(5,6)17-26-21/h11-13,21H,7-10,14-17H2,1-6H3
InChI key： AOHPXURSRIFUGG-UHFFFAOYSA-N
SMILES： CCOP(=O)(Cc1cc(CP(=O)(OCC)OCC)cc(c1)C1OCC(C)(C)CO1)OCC
Systematic name  (3)：
  • [5-(5,5-ジメチル-1,3-ジオキサン-2-イル)-1,3-フェニレンビスメチレン]ビス(ホスホン酸ジエチル)
  • ジエチル ({3-[(ジエトキシホスホリル)メチル]-5-(5,5-ジメチル-1,3-ジオキサン-2-イル)フェニル}メチル)ホスホナート
  • diethyl ({3-[(diethoxyphosphoryl)methyl]-5-(5,5-dimethyl-1,3-dioxan-2-yl)phenyl}methyl)phosphonate
Other name (1)：
  • [5-(5,5-Dimethyl-1,3-dioxane-2-yl)-1,3-phenylenebismethylene]bis(phosphonic acid diethyl) ester
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