Cas no 2159-25-3 (Dodecane-1,1-d2,1-bromo- (7CI,9CI))

Dodecane-1,1-d2,1-bromo- (7CI,9CI) structure
2159-25-3 structure
Product Name:Dodecane-1,1-d2,1-bromo- (7CI,9CI)
CAS No:2159-25-3
MF:C12H25Br
MW:251.243226766586
CID:249862
PubChem ID:90470553
Update Time:2025-04-19

Dodecane-1,1-d2,1-bromo- (7CI,9CI) Chemical and Physical Properties

Names and Identifiers

    • Dodecane-1,1-d2,1-bromo- (7CI,9CI)
    • (1,1-(2)H2)-1-bromo-n-decane
    • 1,1-(2)H-1-bromodecane
    • 1,1-dichloro-1-bromo-acetone
    • 1,1-Dideuterododecylbromid
    • 1.1
    • 1-Brom-1,1-dichlor-aceton
    • 1-bromo[1,1-(2)H2]decane
    • 1-Bromo-1,1-dichloro-2-propanone
    • 1-Bromo-1,1-dichloroacetone
    • 1-bromo-1,1-dichloropropanone
    • 1-bromo-1,1-dideuteriodecane
    • 1-bromo-1,1-dideuterio-dodecane
    • 1-bromo-1,1-dideuterodecane
    • 2-Propanone, 1-bromo-1,1-dichloro-
    • AG-K-49363
    • CTK0A7407
    • neopentyl-1,1'-d2-bromide
    • 1-Bromo-1,1-dideuteriododecane
    • 1-BROMODODECANE-1-D2
    • 2159-25-3
    • Inchi: 1S/C12H25Br/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-12H2,1H3/i12D2
    • InChI Key: PBLNBZIONSLZBU-XUWBISKJSA-N
    • SMILES: BrC([2H])([2H])CCCCCCCCCCC

Computed Properties

  • Exact Mass: 250.12652g/mol
  • Monoisotopic Mass: 250.12652g/mol
  • Isotope Atom Count: 2
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 10
  • Complexity: 81.2
  • 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: 7.1
  • Topological Polar Surface Area: 0?2

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