Cas no 75945-91-4 (4-oxo-1-Phenylcyclohexanecarboxylic acid)

4-oxo-1-Phenylcyclohexanecarboxylic acid structure
75945-91-4 structure
Product Name:4-oxo-1-Phenylcyclohexanecarboxylic acid
CAS No:75945-91-4
MF:C13H14O3
MW:218.248464107513
MDL:MFCD06208311
CID:859325
PubChem ID:343886
Update Time:2025-11-06

4-oxo-1-Phenylcyclohexanecarboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 4-oxo-1-Phenylcyclohexanecarboxylic acid
    • 4-oxo-1-phenylcyclohexane-1-carboxylic acid
    • 1-phenyl-4-oxocyclohexanecarboxylic acid
    • 4-carboxy-4-phenyl-cyclohexanone
    • 4-Oxo-1-phenyl-cyclohexancarbonsaeure
    • 4-oxo-1-phenyl-cyclohexanecarboxylic acid
    • 4-OXO-PHENYLCYCLOHEXANECARBOXYLIC ACID
    • 4-Phenyl-4-carboxy-cyclohexanon-(1)
    • AB23258
    • AC1L7ZBH
    • NSC400458
    • SureCN631791
    • 4-oxo-1-phenylcyclohexanecarboxylicacid
    • CS-0455578
    • FT-0740145
    • GLXVJOPRMXBHSI-UHFFFAOYSA-N
    • EN300-343811
    • A923259
    • NSC-400458
    • 75945-91-4
    • SCHEMBL631791
    • MFCD06208311
    • AS-38304
    • 4-carboxy-4-phenylcyclohexanone
    • AKOS022182150
    • DTXSID30322106
    • NSC 400458
    • DA-03021
    • MDL: MFCD06208311
    • Inchi: 1S/C13H14O3/c14-11-6-8-13(9-7-11,12(15)16)10-4-2-1-3-5-10/h1-5H,6-9H2,(H,15,16)
    • InChI Key: GLXVJOPRMXBHSI-UHFFFAOYSA-N
    • SMILES: OC(C1(C2C=CC=CC=2)CCC(CC1)=O)=O

Computed Properties

  • Exact Mass: 218.09432
  • Monoisotopic Mass: 218.094294304g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 280
  • 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: 1.4
  • Topological Polar Surface Area: 54.4?2

Experimental Properties

  • Density: 1.227±0.06 g/cm3 (20 oC 760 Torr),
  • Melting Point: 120-121 oC (benzene )
  • Boiling Point: 408.7℃ at 760 mmHg
  • Flash Point: 215.2±25.2 °C
  • Solubility: Slightly soluble (2.8 g/l) (25 o C),
  • PSA: 54.37
  • Vapor Pressure: 0.0±1.0 mmHg at 25°C

4-oxo-1-Phenylcyclohexanecarboxylic acid Security Information

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4-oxo-1-Phenylcyclohexanecarboxylic acid Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:75945-91-4)4-oxo-1-Phenylcyclohexanecarboxylic acid
Order Number:A923259
Stock Status:in Stock
Quantity:5g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 14:35
Price ($):716.0
Recommended suppliers
Amadis Chemical Company Limited
(CAS:75945-91-4)4-oxo-1-Phenylcyclohexanecarboxylic acid
A923259
Purity:99%
Quantity:5g
Price ($):716.0
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