Chem
J-GLOBAL ID：200907004042768893   Nikkaji number：J1.276.766H

Benzoic acid (R)-1-ethylhexyl ester

安息香酸(R)-1-エチルヘキシル
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： C15H22O2
Molecular formula furigana： C15-H22-O2
Molecular weight： 234.339
InChI： InChI=1S/C15H22O2/c1-3-5-7-12-14(4-2)17-15(16)13-10-8-6-9-11-13/h6,8-11,14H,3-5,7,12H2,1-2H3/t14-/m1/s1
InChI key： BMVPGSDZBWHZAT-CQSZACIVSA-N
SMILES： CCCCC[C@@H](CC)OC(=O)c1ccccc1
Systematic name  (4)：
  • 安息香酸(R)-1-エチルヘキシル
  • (-)-安息香酸(R)-1-エチルヘキシル
  • (3R)-オクタン-3-イル ベンゾアート
  • (3R)-octan-3-yl benzoate
Other name (2)：
  • Benzoic acid (R)-1-ethylhexyl ester
  • (-)-Benzoic acid (R)-1-ethylhexyl ester
Regulation number (1)：
  • (3)-1356
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