Cas no 117186-04-6 (3,5-bis(trifluoromethyl)cyclohexane-1-carboxylic acid)

3,5-bis(trifluoromethyl)cyclohexane-1-carboxylic acid structure
117186-04-6 structure
Product Name:3,5-bis(trifluoromethyl)cyclohexane-1-carboxylic acid
CAS No:117186-04-6
MF:C9H10F6O2
MW:264.164924144745
MDL:MFCD00278492
CID:3655180
PubChem ID:2727679
Update Time:2025-04-22

3,5-bis(trifluoromethyl)cyclohexane-1-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • Cyclohexanecarboxylic acid, 3,5-bis(trifluoromethyl)-
    • 3,5-bis(trifluoromethyl)cyclohexane-1-carboxylic acid
    • HMS559H07
    • 117186-04-6
    • Maybridge1_006321
    • VKWKCLKUDZHHIX-UHFFFAOYSA-N
    • CCG-53094
    • SR-01000642283-1
    • 3,5-di(trifluoromethyl)cyclohexane-1-carboxylic acid
    • 879-648-9
    • EN300-25485824
    • SCHEMBL849491
    • AKOS000161201
    • MDL： MFCD00278492
    • Inchi： 1S/C9H10F6O2/c10-8(11,12)5-1-4(7(16)17)2-6(3-5)9(13,14)15/h4-6H,1-3H2,(H,16,17)
    • InChI Key： VKWKCLKUDZHHIX-UHFFFAOYSA-N
    • SMILES： FC(C1CC(C(=O)O)CC(C(F)(F)F)C1)(F)F

Computed Properties

  • Exact Mass: 264.05849853Da
  • Monoisotopic Mass: 264.05849853Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 1
  • Complexity: 273
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.3
  • Topological Polar Surface Area: 37.3?2

3,5-bis(trifluoromethyl)cyclohexane-1-carboxylic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
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