Chem
J-GLOBAL ID:200907042299710950   Nikkaji number:J51.686D

(S)-4-Methylheptanoic acid ethyl ester

(S)-4-メチルヘプタン酸エチル
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: C10H20O2
Molecular formula furigana: C10-H20-O2
Molecular weight: 172.268
InChI: InChI=1S/C10H20O2/c1-4-6-9(3)7-8-10(11)12-5-2/h9H,4-8H2,1-3H3/t9-/m0/s1
InChI key: NYSADWJQUICPEE-VIFPVBQESA-N
SMILES: CCC[C@H](C)CCC(=O)OCC
Systematic name  (4):
  • [S,(+)]-4-メチルヘプタン酸エチル
  • (S)-4-メチルヘプタン酸エチル
  • エチル (4S)-4-メチルヘプタノアート
  • ethyl (4S)-4-methylheptanoate
Other name (2):
  • [S,(+)]-4-Methylheptanoic acid ethyl ester
  • (S)-4-Methylheptanoic acid ethyl ester
Regulation number (1):
  • (2)-782
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