Cas no 146085-71-4 (Ethyl 3,5-bis(bromomethyl)benzoate)

Ethyl 3,5-bis(bromomethyl)benzoate structure
146085-71-4 structure
Product Name:Ethyl 3,5-bis(bromomethyl)benzoate
CAS No:146085-71-4
MF:C11H12Br2O2
MW:336.019782066345
CID:2108854
Update Time:2023-08-04

Ethyl 3,5-bis(bromomethyl)benzoate Chemical and Physical Properties

Names and Identifiers

    • ethyl 3,5-bis(bromomethyl)benzoate
    • 3,5-bis[bromomethyl]benzoic acid ethyl ester
    • 3,5-bis(bromomethyl)benzoic acid ethyl ester
    • AFLRUIRVLODVDD-UHFFFAOYSA-N
    • 3,5-Bis(bromomethyl)benzene-1-carboxylic acid ethyl ester
    • Ethyl 3,5-bis(bromomethyl)benzoate
    • Inchi: 1S/C11H12Br2O2/c1-2-15-11(14)10-4-8(6-12)3-9(5-10)7-13/h3-5H,2,6-7H2,1H3
    • InChI Key: AFLRUIRVLODVDD-UHFFFAOYSA-N
    • SMILES: BrCC1C=C(C(=O)OCC)C=C(CBr)C=1

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 5
  • Complexity: 197
  • Topological Polar Surface Area: 26.3
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