Cas no 1261916-94-2 (3-(4-Methoxy-3-trifluoromethylphenyl)-2-methylbenzoic acid)

3-(4-Methoxy-3-trifluoromethylphenyl)-2-methylbenzoic acid is a specialized aromatic carboxylic acid derivative featuring a methoxy and trifluoromethyl substitution on the phenyl ring, along with a methyl group adjacent to the carboxylic acid functionality. This structural configuration imparts unique electronic and steric properties, making it a valuable intermediate in pharmaceutical and agrochemical synthesis. The trifluoromethyl group enhances metabolic stability and lipophilicity, while the methoxy substituent can influence reactivity and binding interactions. The compound’s well-defined structure and functional group compatibility facilitate its use in targeted organic transformations, such as coupling reactions or derivatization for bioactive molecule development. Its purity and stability under standard conditions ensure reliable performance in research and industrial applications.
3-(4-Methoxy-3-trifluoromethylphenyl)-2-methylbenzoic acid structure
1261916-94-2 structure
Product Name:3-(4-Methoxy-3-trifluoromethylphenyl)-2-methylbenzoic acid
CAS No:1261916-94-2
MF:C16H13F3O3
MW:310.267835378647
MDL:MFCD18322800
CID:2763296
PubChem ID:53228619
Update Time:2025-06-07

3-(4-Methoxy-3-trifluoromethylphenyl)-2-methylbenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 1261916-94-2
    • 4'-Methoxy-2-methyl-3'-(trifluoromethyl)[1,1'-biphenyl]-3-carboxylic acid
    • 3-(4-METHOXY-3-TRIFLUOROMETHYLPHENYL)-2-METHYLBENZOIC ACID
    • MFCD18322800
    • 3-(4-Methoxy-3-trifluoromethylphenyl)-2-methylbenzoic acid, 95%
    • DTXSID10692152
    • 3-(4-Methoxy-3-trifluoromethylphenyl)-2-methylbenzoic acid
    • MDL： MFCD18322800
    • Inchi： 1S/C16H13F3O3/c1-9-11(4-3-5-12(9)15(20)21)10-6-7-14(22-2)13(8-10)16(17,18)19/h3-8H,1-2H3,(H,20,21)
    • InChI Key： WIJNPCWMTZRMJQ-UHFFFAOYSA-N
    • SMILES： FC(C1=C(C=CC(=C1)C1C=CC=C(C(=O)O)C=1C)OC)(F)F

Computed Properties

  • Exact Mass: 310.08167876Da
  • Monoisotopic Mass: 310.08167876Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 3
  • Complexity: 397
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.3
  • Topological Polar Surface Area: 46.5?2

3-(4-Methoxy-3-trifluoromethylphenyl)-2-methylbenzoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
abcr
AB330077-5 g
3-(4-Methoxy-3-trifluoromethylphenyl)-2-methylbenzoic acid, 95%; .
 1261916-94-2 95%
5g
 €1159.00 2023-06-21
abcr
AB330077-5g
3-(4-Methoxy-3-trifluoromethylphenyl)-2-methylbenzoic acid, 95%; .
 1261916-94-2 95%
5g
 €1159.00 2025-04-21

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