Cas no 58733-41-8 (benzoic acid, 2-bromo-5-methoxy-, ethyl ester)

benzoic acid, 2-bromo-5-methoxy-, ethyl ester structure
58733-41-8 structure
Product Name:benzoic acid, 2-bromo-5-methoxy-, ethyl ester
CAS No:58733-41-8
MF:C10H11BrO3
MW:259.096542596817
CID:1612103
PubChem ID:43389585
Update Time:2025-04-21

benzoic acid, 2-bromo-5-methoxy-, ethyl ester Chemical and Physical Properties

Names and Identifiers

    • LogP
    • 2-bromo-5-methoxybenzoic acid ethyl ester
    • benzoic acid, 2-bromo-5-methoxy-, ethyl ester
    • ethyl 2-bromo-5-methoxybenzoate
    • DB-338214
    • 2-bromo-5-methoxy-benzoic acid ethyl ester
    • MB03702
    • CS-0365322
    • SCHEMBL4882699
    • 58733-41-8
    • MFCD06204943
    • starbld0034084
    • AKOS008949273
    • FPBWUXGHDYGRLL-UHFFFAOYSA-N
    • Inchi： 1S/C10H11BrO3/c1-3-14-10(12)8-6-7(13-2)4-5-9(8)11/h4-6H,3H2,1-2H3
    • InChI Key： FPBWUXGHDYGRLL-UHFFFAOYSA-N
    • SMILES： BrC1=CC=C(C=C1C(=O)OCC)OC

Computed Properties

  • Exact Mass: 257.98913
  • Monoisotopic Mass: 257.98916g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 196
  • 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: 2.8
  • Topological Polar Surface Area: 35.5?2

Experimental Properties

  • PSA: 35.53

benzoic acid, 2-bromo-5-methoxy-, ethyl ester Pricemore >>

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A2B Chem LLC
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A2B Chem LLC
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A2B Chem LLC
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