Cas no 39773-32-5 (2-Propenoic acid, 3-bromo-)

2-Propenoic acid, 3-bromo- structure
2-Propenoic acid, 3-bromo- structure
Product Name:2-Propenoic acid, 3-bromo-
CAS No:39773-32-5
MF:C3H3BrO2
MW:150.958720445633
CID:5531758
Update Time:2024-03-01

2-Propenoic acid, 3-bromo- Chemical and Physical Properties

Names and Identifiers

    • 2-Propenoic acid, 3-bromo-
    • Inchi: 1S/C3H3BrO2/c4-2-1-3(5)6/h1-2H,(H,5,6)
    • InChI Key: POAWTYXNXPEWCO-UHFFFAOYSA-N
    • SMILES: C(O)(=O)C=CBr

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 6
  • Rotatable Bond Count: 1

Experimental Properties

  • Density: 1.899±0.06 g/cm3(Predicted)
  • Melting Point: 106 °C
  • Boiling Point: 222.4±13.0 °C(Predicted)
  • pka: 3.73±0.10(Predicted)
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