Chem
J-GLOBAL ID：201207027270806482   Nikkaji number：J3.040.310J

5-(Trifluoromethyl)isophthalic acid dimethyl ester

5-(トリフルオロメチル)イソフタル酸ジメチル
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： C11H9F3O4
Molecular formula furigana： C11-H9-F3-O4
Molecular weight： 262.184
InChI： InChI=1S/C11H9F3O4/c1-17-9(15)6-3-7(10(16)18-2)5-8(4-6)11(12,13)14/h3-5H,1-2H3
InChI key： JIIRKRJNBBUTBR-UHFFFAOYSA-N
SMILES： COC(=O)c1cc(cc(c1)C(F)(F)F)C(=O)OC
Systematic name  (3)：
  • 5-(トリフルオロメチル)イソフタル酸ジメチル
  • 1,3-ジメチル 5-(トリフルオロメチル)ベンゼン-1,3-ジカルボキシラート
  • 1,3-dimethyl 5-(trifluoromethyl)benzene-1,3-dicarboxylate
Other name (1)：
  • 5-(Trifluoromethyl)isophthalic acid dimethyl ester
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