Chem
J-GLOBAL ID:200907082422964270   Nikkaji number:J897.558B

Propionic acid (S)-1,5-dimethylhexyl ester

プロピオン酸(S)-1,5-ジメチルヘキシル
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: C11H22O2
Molecular formula furigana: C11-H22-O2
Molecular weight: 186.295
InChI: InChI=1S/C11H22O2/c1-5-11(12)13-10(4)8-6-7-9(2)3/h9-10H,5-8H2,1-4H3/t10-/m0/s1
InChI key: FVMCJAQZZHUSQE-JTQLQIEISA-N
SMILES: CCC(=O)O[C@@H](C)CCCC(C)C
Systematic name  (3):
  • プロピオン酸(S)-1,5-ジメチルヘキシル
  • (2S)-6-メチルヘプタン-2-イル プロパノアート
  • (2S)-6-methylheptan-2-yl propanoate
Other name (1):
  • Propionic acid (S)-1,5-dimethylhexyl ester
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