Chem
J-GLOBAL ID:200907048863845591   Nikkaji number:J1.666.307G

1-(4α-Pentylcyclohexane-1β-yl)-4-(3,4-difluorophenylethynyl)benzene

1-(4α-ペンチルシクロヘキサン-1β-イル)-4-(3,4-ジフルオロフェニルエチニル)ベンゼン
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: C25H28F2
Molecular formula furigana: C25-H28-F2
Molecular weight: 366.496
InChI: InChI=1S/C25H28F2/c1-2-3-4-5-19-8-13-22(14-9-19)23-15-10-20(11-16-23)6-7-21-12-17-24(26)25(27)18-21/h10-12,15-19,22H,2-5,8-9,13-14H2,1H3/t19-,22-
InChI key: MENDSPMCGKYVPW-XYWHTSSQSA-N
SMILES: CCCCC[C@H]1CC[C@@H](CC1)c1ccc(cc1)C#Cc1ccc(F)c(F)c1
Systematic name  (3):
  • 1-(4α-ペンチルシクロヘキサン-1β-イル)-4-(3,4-ジフルオロフェニルエチニル)ベンゼン
  • 1-[2-(3,4-ジフルオロフェニル)エチニル]-4-[(1s,4r)-4-ペンチルシクロヘキシル]ベンゼン
  • 1-[2-(3,4-difluorophenyl)ethynyl]-4-[(1s,4r)-4-pentylcyclohexyl]benzene
Other name (1):
  • 1-(4α-Pentylcyclohexane-1β-yl)-4-(3,4-difluorophenylethynyl)benzene
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