Chem
J-GLOBAL ID：200907068770356427   Nikkaji number：J384.301G

(-)-CP-47497

(1R)-3β-[2-ヒドロキシ-4-(1,1-ジメチルヘプチル)フェニル]シクロヘキサノール
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： C21H34O2
Molecular formula furigana： C21-H34-O2
Molecular weight： 318.501
InChI： InChI=1S/C21H34O2/c1-4-5-6-7-13-21(2,3)17-11-12-19(20(23)15-17)16-9-8-10-18(22)14-16/h11-12,15-16,18,22-23H,4-10,13-14H2,1-3H3/t16-,18+/m0/s1
InChI key： ZWWRREXSUJTKNN-FUHWJXTLSA-N
SMILES： CCCCCCC(C)(C)c1ccc([C@H]2CCC[C@@H](O)C2)c(O)c1
Systematic name  (10)：
  • 2-(3α-ヒドロキシシクロヘキサン-1α-イル)-5-(1,1-ジメチルヘプチル)フェノール
  • (1R)-3β-[4-(1,1-ジメチルヘプチル)-2-ヒドロキシフェニル]シクロヘキサン-1β-オール
  • 5-(1,1-ジメチルヘプチル)-2-[(1α,3α)-3-ヒドロキシシクロヘキサン-1-イル]フェノール
  • 3β-[4-(1,1-ジメチルヘプチル)-2-ヒドロキシフェニル]シクロヘキサン-1β-オール
  • 5-(1,1-ジメチルヘプチル)-2-[(1S,3R)-3-ヒドロキシシクロヘキシル]フェノール
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Other name (8)：
  • 3β-[4-(1,1-Dimethylheptyl)-2-hydroxyphenyl]cyclohexan-1β-ol
  • 5-(1,1-Dimethylheptyl)-2-[(1α,3α)-3-hydroxycyclohexan-1-yl]phenol
  • 5-(1,1-Dimethylheptyl)-2-[(1S,3R)-3-hydroxycyclohexyl]phenol
  • (1R,3S)-3-[2-Hydroxy-4-(2-methyloctane-2-yl)phenyl]cyclohexane-1-ol
  • (1R,3S)-3β-[2-Hydroxy-4-(2-methyloctane-2-yl)phenyl]cyclohexane-1β-ol
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CAS registry number： 114753-51-4
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