Chem
J-GLOBAL ID：200907002326298363   Nikkaji number：J326.454H

3-Chlorohexahydro-3-methyl-2(3H)-benzofuranone

3-クロロヘキサヒドロ-3-メチル-2(3H)-ベンゾフラノン
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： C9H13ClO2
Molecular formula furigana： C9-H13-CL-O2
Molecular weight： 188.650
InChI： InChI=1S/C9H13ClO2/c1-9(10)6-4-2-3-5-7(6)12-8(9)11/h6-7H,2-5H2,1H3
InChI key： CBIKLWCRTLLKFI-UHFFFAOYSA-N
SMILES： CC1(Cl)C2CCCCC2OC1=O
Systematic name  (3)：
  • 3-クロロヘキサヒドロ-3-メチル-2(3H)-ベンゾフラノン
  • 3-クロロ-3-メチル-オクタヒドロ-1-ベンゾフラン-2-オン
  • 3-chloro-3-methyl-octahydro-1-benzofuran-2-one
Other name (1)：
  • 3-Chlorohexahydro-3-methyl-2(3H)-benzofuranone
CAS registry number： 94291-91-5
Regulation number (1)：
  • EINECS3049190
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