Cas no 1131594-14-3 (3-Bromo-4-cyclohexylbenzoic acid)

3-Bromo-4-cyclohexylbenzoic acid structure
1131594-14-3 structure
Product Name:3-Bromo-4-cyclohexylbenzoic acid
CAS No:1131594-14-3
MF:C13H15BrO2
MW:283.161003351212
MDL:MFCD11110885
CID:1030485
PubChem ID:45072104
Update Time:2025-04-20

3-Bromo-4-cyclohexylbenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 3-Bromo-4-cyclohexylbenzoic acid
    • E76225
    • BS-49830
    • DTXSID70662371
    • MFCD11110885
    • AKOS015856068
    • DB-366148
    • CS-0188017
    • 3-Bromo-4-cyclohexylbenzoicacid
    • 1131594-14-3
    • MDL: MFCD11110885
    • Inchi: 1S/C13H15BrO2/c14-12-8-10(13(15)16)6-7-11(12)9-4-2-1-3-5-9/h6-9H,1-5H2,(H,15,16)
    • InChI Key: LUKSCSAUDYSDPM-UHFFFAOYSA-N
    • SMILES: BrC1C=C(C(=O)O)C=CC=1C1CCCCC1

Computed Properties

  • Exact Mass: 282.02554g/mol
  • Monoisotopic Mass: 282.02554g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 248
  • 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: 4.7
  • Topological Polar Surface Area: 37.3?2

3-Bromo-4-cyclohexylbenzoic acid Pricemore >>

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