Chem
J-GLOBAL ID：200907093833682820   Nikkaji number：J2.659.212G

2-Methyl-4,5,6,7-tetrahydrooxepin-3-carboxylic acid benzyl ester

2-メチル-4,5,6,7-テトラヒドロオキセピン-3-カルボン酸ベンジル
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： C15H18O3
Molecular formula furigana： C15-H18-O3
Molecular weight： 246.306
InChI： InChI=1S/C15H18O3/c1-12-14(9-5-6-10-17-12)15(16)18-11-13-7-3-2-4-8-13/h2-4,7-8H,5-6,9-11H2,1H3
InChI key： MLDGDIJJIRJIGP-UHFFFAOYSA-N
SMILES： CC1=C(CCCCO1)C(=O)OCc1ccccc1
Systematic name  (3)：
  • 2-メチル-4,5,6,7-テトラヒドロオキセピン-3-カルボン酸ベンジル
  • ベンジル 2-メチル-4,5,6,7-テトラヒドロオキセピン-3-カルボキシラート
  • benzyl 2-methyl-4,5,6,7-tetrahydrooxepine-3-carboxylate
Other name (1)：
  • 2-Methyl-4,5,6,7-tetrahydrooxepin-3-carboxylic acid benzyl ester
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