Chem
J-GLOBAL ID：200907017383403707   Nikkaji number：J126.504K

1-Methylheptyl acetate

酢酸1-メチルヘプチル
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： C10H20O2
Molecular formula furigana： C10-H20-O2
Molecular weight： 172.268
InChI： InChI=1S/C10H20O2/c1-4-5-6-7-8-9(2)12-10(3)11/h9H,4-8H2,1-3H3
InChI key： SJFUDWKNZGXSLV-UHFFFAOYSA-N
SMILES： CCCCCCC(C)OC(=O)C
Systematic name  (5)：
  • 酢酸1-メチルヘプチル
  • 酢酸オクタン-2-イル
  • 2-オクタノールアセタート
  • オクタン-2-イル アセタート
  • octan-2-yl acetate
Other name (3)：
  • 2-Octanol acetate
  • Acetic acid octan-2-yl ester
  • 1-Methylheptyl acetate
CAS registry number： 2051-50-5
Regulation number (3)：
  • EINECS2181235
  • TSCA(2051-50-5)
  • (2)-735
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