Cas no 1804142-16-2 (3-Bromo-4-propionylphenylacetic acid)

3-Bromo-4-propionylphenylacetic acid structure
1804142-16-2 structure
Product Name:3-Bromo-4-propionylphenylacetic acid
CAS No:1804142-16-2
MF:C11H11BrO3
MW:271.107242822647
CID:4972802
Update Time:2025-07-30

3-Bromo-4-propionylphenylacetic acid Chemical and Physical Properties

Names and Identifiers

    • 3-Bromo-4-propionylphenylacetic acid
    • Inchi: 1S/C11H11BrO3/c1-2-10(13)8-4-3-7(5-9(8)12)6-11(14)15/h3-5H,2,6H2,1H3,(H,14,15)
    • InChI Key: JVGAWLIOKVOSLB-UHFFFAOYSA-N
    • SMILES: BrC1C=C(CC(=O)O)C=CC=1C(CC)=O

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 4
  • Complexity: 252
  • XLogP3: 2.2
  • Topological Polar Surface Area: 54.4

3-Bromo-4-propionylphenylacetic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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1804142-16-2 97%
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