Cas no 284474-47-1 (1-Bromodecane-10,10,10-d3)

1-Bromodecane-10,10,10-d3 is a deuterated alkyl bromide compound where the terminal methyl group is isotopically labeled with three deuterium atoms. This modification enhances its utility in mechanistic studies, kinetic isotope effect investigations, and NMR spectroscopy applications due to the distinct spectroscopic properties imparted by deuterium. The compound serves as a valuable intermediate in organic synthesis, particularly in the preparation of labeled surfactants, polymers, or other deuterated derivatives. Its high isotopic purity and well-defined structure make it suitable for precise analytical and research applications. The presence of the bromine moiety allows for further functionalization via nucleophilic substitution or cross-coupling reactions.
1-Bromodecane-10,10,10-d3 structure
1-Bromodecane-10,10,10-d3 structure
Product Name:1-Bromodecane-10,10,10-d3
CAS No:284474-47-1
MF:C10H21Br
MW:224.196227788925
CID:248466
PubChem ID:71308869
Update Time:2025-05-28

1-Bromodecane-10,10,10-d3 Chemical and Physical Properties

Names and Identifiers

    • Decane-1,1,1-d3,10-bromo- (9CI)
    • 10-bromo-1,1,1-trideuteriodecane
    • 1-Bromodecane-10,10,10-d3, 98 atom % D, 98% (CP)
    • D98495
    • CS-0568480
    • 1-Bromodecane-d3
    • 1-Bromodecane-10,10,10-d3
    • HY-W099613S1
    • 284474-47-1
    • Inchi： 1S/C10H21Br/c1-2-3-4-5-6-7-8-9-10-11/h2-10H2,1H3/i1D3
    • InChI Key： MYMSJFSOOQERIO-FIBGUPNXSA-N
    • SMILES： BrCCCCCCCCCC([2H])([2H])[2H]

Computed Properties

  • Exact Mass: 223.101
  • Monoisotopic Mass: 223.101
  • Isotope Atom Count: 3
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 8
  • Complexity: 61.9
  • 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: 6
  • Topological Polar Surface Area: 0A^2

Experimental Properties

  • Density: 1.080?g/mL?at 25?°C
  • Boiling Point: 238?°C(lit.)
  • Flash Point: 94?°C

1-Bromodecane-10,10,10-d3 Security Information

1-Bromodecane-10,10,10-d3 Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
B682842-2.5mg
1-Bromodecane-10,10,10-d3
 284474-47-1
2.5mg
 $ 64.00 2023-09-08
TRC
B682842-5mg
1-Bromodecane-10,10,10-d3
 284474-47-1
5mg
 $ 81.00 2023-09-08
TRC
B682842-25mg
1-Bromodecane-10,10,10-d3
 284474-47-1
25mg
 $ 224.00 2023-04-18

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