Chem
J-GLOBAL ID:201407019275761721   Nikkaji number:J3.276.722B

4-(2,2-Difluoro-3-oxocyclononane-1-ylmethyl)benzoic acid methyl ester

メチル 4-[(2,2-ジフルオロ-3-オキソシクロノニル)メチル]ベンゾアート
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: C18H22F2O3
Molecular formula furigana: C18-H22-F2-O3
Molecular weight: 324.368
InChI: InChI=1S/C18H22F2O3/c1-23-17(22)14-10-8-13(9-11-14)12-15-6-4-2-3-5-7-16(21)18(15,19)20/h8-11,15H,2-7,12H2,1H3
InChI key: RHPLJQWTDMWIIP-UHFFFAOYSA-N
SMILES: COC(=O)c1ccc(CC2CCCCCCC(=O)C2(F)F)cc1
Systematic name  (3):
  • 4-(2,2-ジフルオロ-3-オキソシクロノナン-1-イルメチル)安息香酸メチル
  • メチル 4-[(2,2-ジフルオロ-3-オキソシクロノニル)メチル]ベンゾアート
  • methyl 4-[(2,2-difluoro-3-oxocyclononyl)methyl]benzoate
Other name (1):
  • 4-(2,2-Difluoro-3-oxocyclononane-1-ylmethyl)benzoic acid methyl ester
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