Chem
J-GLOBAL ID:200907037476048380   Nikkaji number:J948.067F

Acrylic acid 6-[4-[(E)-2-[4-[(2S)-2-methylbutyl]phenyl]ethenyl]phenoxy]hexyl ester

アクリル酸6-[4-[(E)-2-[4-[(2S)-2-メチルブチル]フェニル]エテニル]フェノキシ]ヘキシル
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: C28H36O3
Molecular formula furigana: C28-H36-O3
Molecular weight: 420.593
InChI: InChI=1S/C28H36O3/c1-4-23(3)22-26-14-12-24(13-15-26)10-11-25-16-18-27(19-17-25)30-20-8-6-7-9-21-31-28(29)5-2/h5,10-19,23H,2,4,6-9,20-22H2,1,3H3/b11-10+/t23-/m0/s1
InChI key: RSPFMNKKIWBJBG-YSESTWPTSA-N
SMILES: CC[C@H](C)Cc1ccc(/C=C/c2ccc(OCCCCCCOC(=O)C=C)cc2)cc1
Systematic name  (3):
  • アクリル酸6-[4-[(E)-2-[4-[(2S)-2-メチルブチル]フェニル]エテニル]フェノキシ]ヘキシル
  • 6-{4-[(1E)-2-{4-[(2S)-2-メチルブチル]フェニル}エテニル]フェノキシ}ヘキシル プロパ-2-エノアート
  • 6-{4-[(1E)-2-{4-[(2S)-2-methylbutyl]phenyl}ethenyl]phenoxy}hexyl prop-2-enoate
Other name (1):
  • Acrylic acid 6-[4-[(E)-2-[4-[(2S)-2-methylbutyl]phenyl]ethenyl]phenoxy]hexyl ester
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