Cas no 2260904-65-0 (3-Ethynyl-5-(trifluoromethyl)benzoic acid)

3-Ethynyl-5-(trifluoromethyl)benzoic acid structure
2260904-65-0 structure
Product Name:3-Ethynyl-5-(trifluoromethyl)benzoic acid
CAS No:2260904-65-0
MF:C10H5F3O2
MW:214.140713453293
MDL:MFCD32874624
CID:5667778
PubChem ID:137380350
Update Time:2023-09-12

3-Ethynyl-5-(trifluoromethyl)benzoic acid Chemical and Physical Properties

Names and Identifiers

    • A1-40877
    • 2260904-65-0
    • EN300-27101919
    • 3-Ethynyl-5-(trifluoromethyl)benzoic acid
    • SCHEMBL20610195
    • GKWHSPIZHNPYNO-UHFFFAOYSA-N
    • Z3796674961
    • MDL: MFCD32874624
    • Inchi: 1S/C10H5F3O2/c1-2-6-3-7(9(14)15)5-8(4-6)10(11,12)13/h1,3-5H,(H,14,15)
    • InChI Key: GKWHSPIZHNPYNO-UHFFFAOYSA-N
    • SMILES: FC(C1C=C(C#C)C=C(C(=O)O)C=1)(F)F

Computed Properties

  • Exact Mass: 214.02416388g/mol
  • Monoisotopic Mass: 214.02416388g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 300
  • 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: 2.6
  • Topological Polar Surface Area: 37.3?2

3-Ethynyl-5-(trifluoromethyl)benzoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
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3-ethynyl-5-(trifluoromethyl)benzoic acid
2260904-65-0 95.0%
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Enamine
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2260904-65-0 95.0%
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Enamine
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Enamine
EN300-27101919-10.0g
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Enamine
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