Chem
J-GLOBAL ID：200907081390265379   Nikkaji number：J1.964.009D

4-Methoxybenzoic acid (1,2α-dihydroxycyclohexane-1β-yl)methyl ester

4-メトキシ安息香酸(1,2α-ジヒドロキシシクロヘキサン-1β-イル)メチル
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： C15H20O5
Molecular formula furigana： C15-H20-O5
Molecular weight： 280.320
InChI： InChI=1S/C15H20O5/c1-19-12-7-5-11(6-8-12)14(17)20-10-15(18)9-3-2-4-13(15)16/h5-8,13,16,18H,2-4,9-10H2,1H3/t13-,15-/m1/s1
InChI key： KMSNTSFXBCZSQM-UKRRQHHQSA-N
SMILES： COc1ccc(cc1)C(=O)OC[C@]1(O)CCCC[C@H]1O
Systematic name  (3)：
  • 4-メトキシ安息香酸(1,2α-ジヒドロキシシクロヘキサン-1β-イル)メチル
  • [(1R,2R)-1,2-ジヒドロキシシクロヘキシル]メチル 4-メトキシベンゾアート
  • [(1R,2R)-1,2-dihydroxycyclohexyl]methyl 4-methoxybenzoate
Other name (1)：
  • 4-Methoxybenzoic acid (1,2α-dihydroxycyclohexane-1β-yl)methyl ester
Thsaurus map：
Thesaurus Map

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