Cas no 1364687-69-3 (2-bromo-3-ethoxy-4-methoxybenzaldehyde)

2-bromo-3-ethoxy-4-methoxybenzaldehyde structure
1364687-69-3 structure
Product Name:2-bromo-3-ethoxy-4-methoxybenzaldehyde
CAS No:1364687-69-3
MF:C10H11BrO3
MW:259.096542596817
CID:2105059
Update Time:2023-11-19

2-bromo-3-ethoxy-4-methoxybenzaldehyde Chemical and Physical Properties

Names and Identifiers

    • 2-bromo-3-ethoxy-4-methoxyBenzaldehyde
    • ZWNDLMVFMRHODN-UHFFFAOYSA-N
    • 2-Bromo-3-ethoxy-4-methoxy-benzaldehyde
    • CID 86664745
    • Benzaldehyde, 2-bromo-3-ethoxy-4-methoxy-
    • 2-bromo-3-ethoxy-4-methoxybenzaldehyde
    • Inchi: 1S/C10H11BrO3/c1-3-14-10-8(13-2)5-4-7(6-12)9(10)11/h4-6H,3H2,1-2H3
    • InChI Key: ZWNDLMVFMRHODN-UHFFFAOYSA-N
    • SMILES: BrC1=C(C=O)C=CC(=C1OCC)OC

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 186
  • Topological Polar Surface Area: 35.5

Experimental Properties

  • Density: 1.425±0.06 g/cm3(Predicted)
  • Boiling Point: 324.1±37.0 °C(Predicted)
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