Cas no 61639-11-0 (Decane, 1-bromo-4-(bromomethyl)-)

Decane, 1-bromo-4-(bromomethyl)- structure
61639-11-0 structure
Product Name:Decane, 1-bromo-4-(bromomethyl)-
CAS No:61639-11-0
MF:C11H22Br2
MW:314.100382328033
CID:471801
PubChem ID:536423
Update Time:2025-04-19

Decane, 1-bromo-4-(bromomethyl)- Chemical and Physical Properties

Names and Identifiers

    • Decane, 1-bromo-4-(bromomethyl)-
    • 1-bromo-4-(bromomethyl)decane
    • OVSIAEWZPMVAOF-UHFFFAOYSA-N
    • 1-Bromo-4-bromomethyldecane
    • DTXSID90336800
    • 61639-11-0
    • Inchi: 1S/C11H22Br2/c1-2-3-4-5-7-11(10-13)8-6-9-12/h11H,2-10H2,1H3
    • InChI Key: OVSIAEWZPMVAOF-UHFFFAOYSA-N
    • SMILES: BrCC(CCCBr)CCCCCC

Computed Properties

  • Exact Mass: 312.00886
  • Monoisotopic Mass: 312.00883g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 9
  • Complexity: 94.1
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 5.8
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • PSA: 0
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