Cas no 21060-31-1 (Ethanone, 1-(4-phenylcyclohexyl)-, trans-)

Technical Introduction: Ethanone, 1-(4-phenylcyclohexyl)-, trans-, is a substituted cyclohexyl ketone characterized by its trans-configuration and phenyl functional group. This compound exhibits structural rigidity due to the cyclohexyl backbone, enhancing its stability in synthetic applications. The phenyl substituent contributes to its aromatic properties, making it useful in organic synthesis, particularly as an intermediate for pharmaceuticals or advanced materials. The trans-orientation ensures steric uniformity, which can be critical for selective reactions. Its well-defined molecular structure allows for predictable reactivity, facilitating its use in controlled transformations. This compound is typically handled under standard laboratory conditions, with purity and isomer consistency being key quality parameters.
Ethanone, 1-(4-phenylcyclohexyl)-, trans- structure
21060-31-1 structure
Product Name:Ethanone, 1-(4-phenylcyclohexyl)-, trans-
CAS No:21060-31-1
MF:C14H18O
MW:202.292124271393
MDL:MFCD34603201
CID:239517
PubChem ID:12883749
Update Time:2025-10-19

Ethanone, 1-(4-phenylcyclohexyl)-, trans- Chemical and Physical Properties

Names and Identifiers

    • Ethanone,1-(trans-4-phenylcyclohexyl)-
    • Ethanone, 1-(4-phenylcyclohexyl)-, trans-
    • trans-1-(4-Phenyl-cyclohexyl)-ethanone
    • MDL: MFCD34603201
    • Inchi: 1S/C14H18O/c1-11(15)12-7-9-14(10-8-12)13-5-3-2-4-6-13/h2-6,12,14H,7-10H2,1H3/t12-,14-
    • InChI Key: WADKHEBRFDWZCK-MQMHXKEQSA-N
    • SMILES: C(=O)([C@@H]1CC[C@@H](C2=CC=CC=C2)CC1)C

Computed Properties

  • Exact Mass: 202.135765193g/mol
  • Monoisotopic Mass: 202.135765193g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 207
  • 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: 3.2
  • Topological Polar Surface Area: 17.1?2

Ethanone, 1-(4-phenylcyclohexyl)-, trans- Pricemore >>

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