Chem
J-GLOBAL ID：200907015684703738   Nikkaji number：J462.979E

Benzoic acid (2S)-2-hydroxyheptyl ester

安息香酸(2S)-2-ヒドロキシヘプチル
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： C14H20O3
Molecular formula furigana： C14-H20-O3
Molecular weight： 236.311
InChI： InChI=1S/C14H20O3/c1-2-3-5-10-13(15)11-17-14(16)12-8-6-4-7-9-12/h4,6-9,13,15H,2-3,5,10-11H2,1H3/t13-/m0/s1
InChI key： IFOWNPZXTKQLPI-ZDUSSCGKSA-N
SMILES： CCCCC[C@H](O)COC(=O)c1ccccc1
Systematic name  (3)：
  • 安息香酸(2S)-2-ヒドロキシヘプチル
  • (2S)-2-ヒドロキシヘプチル ベンゾアート
  • (2S)-2-hydroxyheptyl benzoate
Other name (1)：
  • Benzoic acid (2S)-2-hydroxyheptyl ester
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