Chem
J-GLOBAL ID：200907086293496376   Nikkaji number：J1.934.743E

2-[(2E,4E)-5-Phenyl-2,4-pentadienyl]-2-[(3E)-3,5-hexadienyl]malonic acid bis(2,2,2-trifluoroethyl) ester

2-[(2E,4E)-5-フェニル-2,4-ペンタジエニル]-2-[(3E)-3,5-ヘキサジエニル]マロン酸ビス(2,2,2-トリフルオロエチル)
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： C24H24F6O4
Molecular formula furigana： C24-H24-F6-O4
Molecular weight： 490.442
InChI： InChI=1S/C24H24F6O4/c1-2-3-4-10-15-22(20(31)33-17-23(25,26)27,21(32)34-18-24(28,29)30)16-11-6-9-14-19-12-7-5-8-13-19/h2-9,11-14H,1,10,15-18H2/b4-3+,11-6+,14-9+
InChI key： FTARLMJDPGTSKN-IUAUMVNCSA-N
SMILES： FC(F)(F)COC(=O)C(CC/C=C/C=C)(C/C=C/C=C/c1ccccc1)C(=O)OCC(F)(F)F
Systematic name  (3)：
  • 2-[(2E,4E)-5-フェニル-2,4-ペンタジエニル]-2-[(3E)-3,5-ヘキサジエニル]マロン酸ビス(2,2,2-トリフルオロエチル)
  • 1,3-ビス(2,2,2-トリフルオロエチル) 2-[(3E)-ヘキサ-3,5-ジエン-1-イル]-2-[(2E,4E)-5-フェニルペンタ-2,4-ジエン-1-イル]プロパンジオアート
  • 1,3-bis(2,2,2-trifluoroethyl) 2-[(3E)-hexa-3,5-dien-1-yl]-2-[(2E,4E)-5-phenylpenta-2,4-dien-1-yl]propanedioate
Other name (1)：
  • 2-[(2E,4E)-5-Phenyl-2,4-pentadienyl]-2-[(3E)-3,5-hexadienyl]malonic acid bis(2,2,2-trifluoroethyl) ester
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