Cas no 64425-63-4 (1,4-Bis(2-bromoethyl)-2,5-dimethoxybenzene)

1,4-Bis(2-bromoethyl)-2,5-dimethoxybenzene structure
64425-63-4 structure
Product Name:1,4-Bis(2-bromoethyl)-2,5-dimethoxybenzene
CAS No:64425-63-4
MF:C12H16Br2O2
MW:352.062242507935
CID:2792033
PubChem ID:12354161
Update Time:2025-04-21

1,4-Bis(2-bromoethyl)-2,5-dimethoxybenzene Chemical and Physical Properties

Names and Identifiers

    • 64425-63-4
    • DTXSID50493589
    • 1,4-Bis(2-bromoethyl)-2,5-dimethoxybenzene
    • Inchi: 1S/C12H16Br2O2/c1-15-11-7-10(4-6-14)12(16-2)8-9(11)3-5-13/h7-8H,3-6H2,1-2H3
    • InChI Key: MPCPIXXWLGLTSB-UHFFFAOYSA-N
    • SMILES: BrCCC1C=C(C(=CC=1OC)CCBr)OC

Computed Properties

  • Exact Mass: 351.94966Da
  • Monoisotopic Mass: 349.95170Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 6
  • Complexity: 170
  • 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: 4.3
  • Topological Polar Surface Area: 18.5?2
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