Chem
J-GLOBAL ID：200907002370780288   Nikkaji number：J2.672.835E

1β-(4-Fluorophenyl)-4α-methylcyclohexanecarboxylic acid tert-butyl ester

1β-(4-フルオロフェニル)-4α-メチルシクロヘキサンカルボン酸tert-ブチル
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： C18H25FO2
Molecular formula furigana： C18-H25-F-O2
Molecular weight： 292.394
InChI： InChI=1S/C18H25FO2/c1-13-9-11-18(12-10-13,16(20)21-17(2,3)4)14-5-7-15(19)8-6-14/h5-8,13H,9-12H2,1-4H3/t13-,18+
InChI key： TUGCOOLXWMCWLE-QGGXVJLZSA-N
SMILES： C[C@H]1CC[C@](CC1)(C(=O)OC(C)(C)C)c1ccc(F)cc1
Systematic name  (3)：
  • 1β-(4-フルオロフェニル)-4α-メチルシクロヘキサンカルボン酸tert-ブチル
  • tert-ブチル (1s,4s)-1-(4-フルオロフェニル)-4-メチルシクロヘキサン-1-カルボキシラート
  • tert-butyl (1s,4s)-1-(4-fluorophenyl)-4-methylcyclohexane-1-carboxylate
Other name (1)：
  • 1β-(4-Fluorophenyl)-4α-methylcyclohexanecarboxylic acid tert-butyl ester
Thsaurus map：
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