Chem
J-GLOBAL ID：200907032631532100   Nikkaji number：J627.973B

3-Fluoro-4-(octyloxy)benzoic acid 4-(decyloxy)phenacyl ester

3-フルオロ-4-(オクチルオキシ)安息香酸4-(デシルオキシ)フェナシル
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： C33H47FO5
Molecular formula furigana： C33-H47-F-O5
Molecular weight： 542.732
InChI： InChI=1S/C33H47FO5/c1-3-5-7-9-11-12-14-15-23-37-29-20-17-27(18-21-29)31(35)26-39-33(36)28-19-22-32(30(34)25-28)38-24-16-13-10-8-6-4-2/h17-22,25H,3-16,23-24,26H2,1-2H3
InChI key： HUDQDMVYLHDGOM-UHFFFAOYSA-N
SMILES： CCCCCCCCCCOc1ccc(cc1)C(=O)COC(=O)c1ccc(OCCCCCCCC)c(F)c1
Systematic name  (3)：
  • 3-フルオロ-4-(オクチルオキシ)安息香酸4-(デシルオキシ)フェナシル
  • 2-[4-(デシルオキシ)フェニル]-2-オキソエチル 3-フルオロ-4-(オクチルオキシ)ベンゾアート
  • 2-[4-(decyloxy)phenyl]-2-oxoethyl 3-fluoro-4-(octyloxy)benzoate
Other name (1)：
  • 3-Fluoro-4-(octyloxy)benzoic acid 4-(decyloxy)phenacyl ester
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