Chem
J-GLOBAL ID:200907078364255798   Nikkaji number:J1.487.079B

1-Pyrenebutyric acid methyl ester

1-ピレン酪酸メチル
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: C21H18O2
Molecular formula furigana: C21-H18-O2
Molecular weight: 302.373
InChI: InChI=1S/C21H18O2/c1-23-19(22)7-3-4-14-8-9-17-11-10-15-5-2-6-16-12-13-18(14)21(17)20(15)16/h2,5-6,8-13H,3-4,7H2,1H3
InChI key: IFGBWZMAYOBIGC-UHFFFAOYSA-N
SMILES: COC(=O)CCCc1ccc2ccc3cccc4ccc1c2c34
Systematic name  (5):
  • ピレン-1-ブタン酸メチル
  • 1-ピレン酪酸メチル
  • 4-(1-ピレニル)ブタン酸メチル
  • メチル 4-(ピレン-1-イル)ブタノアート
  • methyl 4-(pyren-1-yl)butanoate
Other name (3):
  • Pyrene-1-butanoic acid methyl ester
  • 1-Pyrenebutyric acid methyl ester
  • 4-(1-Pyrenyl)butanoic acid methyl ester
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