Cas no 1131594-38-1 (Methyl 3-bromo-4-cyclohexylbenzoate)

Methyl 3-bromo-4-cyclohexylbenzoate structure
1131594-38-1 structure
Product Name:Methyl 3-bromo-4-cyclohexylbenzoate
CAS No:1131594-38-1
MF:C14H17BrO2
MW:297.187583684921
CID:1030457
PubChem ID:45072130
Update Time:2025-04-20

Methyl 3-bromo-4-cyclohexylbenzoate Chemical and Physical Properties

Names and Identifiers

    • Methyl 3-bromo-4-cyclohexylbenzoate
    • BS-49819
    • MFCD11113008
    • 1131594-38-1
    • AKOS015851983
    • DB-370807
    • Methyl3-bromo-4-cyclohexylbenzoate
    • CS-0188018
    • DTXSID30662397
    • E76226
    • Inchi: 1S/C14H17BrO2/c1-17-14(16)11-7-8-12(13(15)9-11)10-5-3-2-4-6-10/h7-10H,2-6H2,1H3
    • InChI Key: XGXNPFGTJDHREQ-UHFFFAOYSA-N
    • SMILES: BrC1C=C(C(=O)OC)C=CC=1C1CCCCC1

Computed Properties

  • Exact Mass: 296.041
  • Monoisotopic Mass: 296.041
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 3
  • Complexity: 261
  • 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
  • Topological Polar Surface Area: 26.3A^2
  • XLogP3: 5

Methyl 3-bromo-4-cyclohexylbenzoate Pricemore >>

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