Chem
J-GLOBAL ID：200907084391993989   Nikkaji number：J1.630.846C

2,4,5-Trifluoro-3-methoxybenzoic acid

2,4,5-トリフルオロ-3-メトキシ安息香酸
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： C8H5F3O3
Molecular formula furigana： C8-H5-F3-O3
Molecular weight： 206.120
InChI： InChI=1S/C8H5F3O3/c1-14-7-5(10)3(8(12)13)2-4(9)6(7)11/h2H,1H3,(H,12,13)
InChI key： YVJHZWWMKFQKDC-UHFFFAOYSA-N
SMILES： COc1c(F)c(F)cc(C(=O)O)c1F
Systematic name  (3)：
  • 2,4,5-トリフルオロ-3-メトキシ安息香酸
  • 3-メトキシ-2,4,5-トリフルオロ安息香酸
  • 2,4,5-trifluoro-3-methoxybenzoic acid
Other name (2)：
  • 2,4,5-Trifluoro-3-methoxybenzoic acid
  • 3-Methoxy-2,4,5-trifluorobenzoic acid
CAS registry number： 112811-65-1
Regulation number (2)：
  • 4-(4)-1068
  • (3)-4378
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