Chem
J-GLOBAL ID：201107070502352101   Nikkaji number：J2.982.842C

3,3-Bis[4-(trifluoromethyl)phenyl]propanoic acid methyl ester

3,3-ビス[4-(トリフルオロメチル)フェニル]プロパン酸メチル
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： C18H14F6O2
Molecular formula furigana： C18-H14-F6-O2
Molecular weight： 376.298
InChI： InChI=1S/C18H14F6O2/c1-26-16(25)10-15(11-2-6-13(7-3-11)17(19,20)21)12-4-8-14(9-5-12)18(22,23)24/h2-9,15H,10H2,1H3
InChI key： SLOVIJULZPLKIW-UHFFFAOYSA-N
SMILES： COC(=O)CC(c1ccc(cc1)C(F)(F)F)c1ccc(cc1)C(F)(F)F
Systematic name  (3)：
  • 3,3-ビス[4-(トリフルオロメチル)フェニル]プロパン酸メチル
  • メチル 3,3-ビス[4-(トリフルオロメチル)フェニル]プロパノアート
  • methyl 3,3-bis[4-(trifluoromethyl)phenyl]propanoate
Other name (1)：
  • 3,3-Bis[4-(trifluoromethyl)phenyl]propanoic acid methyl ester
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