Chem
J-GLOBAL ID:200907026166184150   Nikkaji number:J2.215.363C

5-[(E)-4-(5,5-Dimethyl-1,3-dioxane-2-yl)-2,5-dipropylstyryl]-2-thienylmethylphosphonic acid diethyl ester

5-[(E)-4-(5,5-ジメチル-1,3-ジオキサン-2-イル)-2,5-ジプロピルスチリル]-2-チエニルメチル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: C29H43O5PS
Molecular formula furigana: C29-H43-O5-P-S
Molecular weight: 534.690
InChI: InChI=1S/C29H43O5PS/c1-7-11-22-18-27(28-31-20-29(5,6)21-32-28)24(12-8-2)17-23(22)13-14-25-15-16-26(36-25)19-35(30,33-9-3)34-10-4/h13-18,28H,7-12,19-21H2,1-6H3/b14-13+
InChI key: MBBHHMDVYHTCRI-BUHFOSPRSA-N
SMILES: CCCc1cc(C2OCC(C)(C)CO2)c(CCC)cc1/C=C/c1ccc(CP(=O)(OCC)OCC)s1
Systematic name  (3):
  • 5-[(E)-4-(5,5-ジメチル-1,3-ジオキサン-2-イル)-2,5-ジプロピルスチリル]-2-チエニルメチルホスホン酸ジエチル
  • ジエチル ({5-[(1E)-2-[4-(5,5-ジメチル-1,3-ジオキサン-2-イル)-2,5-ジプロピルフェニル]エテニル]チオフェン-2-イル}メチル)ホスホナート
  • diethyl ({5-[(1E)-2-[4-(5,5-dimethyl-1,3-dioxan-2-yl)-2,5-dipropylphenyl]ethenyl]thiophen-2-yl}methyl)phosphonate
Other name (1):
  • 5-[(E)-4-(5,5-Dimethyl-1,3-dioxane-2-yl)-2,5-dipropylstyryl]-2-thienylmethylphosphonic acid diethyl ester
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