Cas no 1226808-68-9 (3-Bromo-5-propoxybenzoic acid)

3-Bromo-5-propoxybenzoic acid structure
3-Bromo-5-propoxybenzoic acid structure
Product Name:3-Bromo-5-propoxybenzoic acid
CAS No:1226808-68-9
MF:C10H11BrO3
MW:259.096542596817
CID:1037547
PubChem ID:53217018
Update Time:2025-11-03

3-Bromo-5-propoxybenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 3-Bromo-5-propoxybenzoic acid
    • ACMC-209am0
    • AG-L-21296
    • AK106594
    • ANW-18022
    • CTK4B3217
    • MolPort-015-143-684
    • BZB80868
    • DTXSID20682125
    • AKOS015834276
    • BS-21300
    • 3-Bromo-5-propoxybenzoicacid
    • 1226808-68-9
    • Benzoic acid, 3-bromo-5-propoxy-
    • E91116
    • DB-366261
    • MFCD16295104
    • CS-0192451
    • MDL: MFCD16295104
    • Inchi: 1S/C10H11BrO3/c1-2-3-14-9-5-7(10(12)13)4-8(11)6-9/h4-6H,2-3H2,1H3,(H,12,13)
    • InChI Key: OFSWAAVHABKEGJ-UHFFFAOYSA-N
    • SMILES: BrC1C=C(C(=O)O)C=C(C=1)OCCC

Computed Properties

  • Exact Mass: 257.98900
  • Monoisotopic Mass: 257.98916g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • 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: 3
  • Topological Polar Surface Area: 46.5?2

Experimental Properties

  • PSA: 46.53000
  • LogP: 2.93610

3-Bromo-5-propoxybenzoic acid Customs Data

  • HS CODE:2918990090
  • Customs Data:

    China Customs Code:

    2918990090

    Overview:

    2918990090. Other additional oxy carboxylic acids(Including anhydrides\Acyl halide\Peroxides, peroxyacids and derivatives of this tax number). VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

3-Bromo-5-propoxybenzoic acid Pricemore >>

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