Chem
J-GLOBAL ID：201807011859450930   Nikkaji number：J3.702.165B

3-(4-Chlorobutyl)-6-methoxyisobenzofuran-1(3H)-one

3-(4-クロロブチル)-6-メトキシイソベンゾフラン-1(3H)-オン
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： C13H15ClO3
Molecular formula furigana： C13-H15-CL-O3
Molecular weight： 254.710
InChI： InChI=1S/C13H15ClO3/c1-16-9-5-6-10-11(8-9)13(15)17-12(10)4-2-3-7-14/h5-6,8,12H,2-4,7H2,1H3
InChI key： FWPQSNFSHYPLHT-UHFFFAOYSA-N
SMILES： COc1ccc2C(CCCCCl)OC(=O)c2c1
Systematic name  (3)：
  • 3-(4-クロロブチル)-6-メトキシイソベンゾフラン-1(3H)-オン
  • 3-(4-クロロブチル)-6-メトキシ-1,3-ジヒドロ-2-ベンゾフラン-1-オン
  • 3-(4-chlorobutyl)-6-methoxy-1,3-dihydro-2-benzofuran-1-one
Other name (1)：
  • 3-(4-Chlorobutyl)-6-methoxyisobenzofuran-1(3H)-one
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