Cas no 41727-47-3 (Methyl 3,5-dibromo-4-hydroxybenzoate)

Methyl 3,5-dibromo-4-hydroxybenzoate is a brominated aromatic ester with the molecular formula C8H6Br2O3. This compound is characterized by its high purity and stability, making it suitable for use as an intermediate in organic synthesis, particularly in pharmaceutical and agrochemical applications. The presence of bromine atoms at the 3 and 5 positions enhances its reactivity in electrophilic substitution reactions, while the ester group improves solubility in organic solvents. Its well-defined structure and consistent quality ensure reliable performance in research and industrial processes. The compound is typically supplied as a white to off-white crystalline powder, with strict adherence to analytical standards for optimal reproducibility.
Methyl 3,5-dibromo-4-hydroxybenzoate structure
41727-47-3 structure
Product Name:Methyl 3,5-dibromo-4-hydroxybenzoate
CAS No:41727-47-3
MF:C8H6Br2O3
MW:309.939441204071
MDL:MFCD00016416
CID:89481
PubChem ID:87568926
Update Time:2025-05-19

Methyl 3,5-dibromo-4-hydroxybenzoate Chemical and Physical Properties

Names and Identifiers

    • Methyl 3,5-dibromo-4-hydroxybenzoate
    • Methyl 3,5-Dibromo-4-hydroxybenzoate Monohydrate
    • 3,5-dibromo-4-hydroxybenzoate
    • 3,5-Dibromo-4-hydroxybenzoic Acid Methyl Ester Monohydrate
    • 3,5-Dibromo-4-hydroxybenzoic Acid Methyl Ester
    • NVGJGYZKXBLIKY-UHFFFAOYSA-N
    • 3,5-dibromo-4-hydroxy-benzoic acid methyl ester
    • methyl 3,5-bis(bromanyl)-4-oxidanyl-benzoate
    • PubChem3978
    • METHYL DIBROMOSALICYLATE
    • IFLab1_001630
    • RARECHEM AL BF 0231
    • HMS1416K02
    • OR7292
    • ST
    • FT-0614498
    • A873013
    • SCHEMBL282481
    • 41727-47-3
    • AKOS001776659
    • 3 pound not5-dibromo-4-hydroxybenzoate
    • AS-62712
    • NCGC00329476-01
    • D2501
    • Boc-5-Aminovalericacid
    • EINECS 255-521-8
    • A825804
    • DTXSID90194523
    • NS00031044
    • F0392-0094
    • Benzoic acid, 3,5-dibromo-4-hydroxy-, methyl ester
    • MFCD00016416
    • A825636
    • 3,5-dibromo-4-hydroxy-, methyl ester Benzoic acid
    • InChI=1/C8H6Br2O3/c1-13-8(12)4-2-5(9)7(11)6(10)3-4/h2-3,11H,1H
    • SR-01000509707
    • SR-01000509707-1
    • AB01323307-02
    • DB-070215
    • STK749187
    • A10122
    • SY057033
    • MDL: MFCD00016416
    • Inchi: 1S/C8H6Br2O3/c1-13-8(12)4-2-5(9)7(11)6(10)3-4/h2-3,11H,1H3
    • InChI Key: NVGJGYZKXBLIKY-UHFFFAOYSA-N
    • SMILES: BrC1C(=C(C=C(C(=O)OC)C=1)Br)O
    • BRN: 2373854

Computed Properties

  • Exact Mass: 307.86800
  • Monoisotopic Mass: 307.868369
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 186
  • 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
  • Surface Charge: 0
  • Tautomer Count: 4

Experimental Properties

  • Color/Form: powder
  • Density: 1.9544 (rough estimate)
  • Melting Point: 122.0 to 125.0 deg-C
  • Boiling Point: 297.2±35.0 °C at 760 mmHg
  • Flash Point: 133.5±25.9 °C
  • Refractive Index: 1.4947 (estimate)
  • Water Partition Coefficient: Slightly soluble in water.
  • PSA: 46.53000
  • LogP: 2.70380
  • Solubility: Not determined

Methyl 3,5-dibromo-4-hydroxybenzoate Security Information

Methyl 3,5-dibromo-4-hydroxybenzoate Customs Data

  • HS CODE:2918290000
  • Customs Data:

    China Customs Code:

    2918290000

    Overview:

    2918290000 Other carboxylic acids and anhydrides containing phenolic groups but not other oxy groups\Acyl halide\Peroxides and peroxyacids and their derivatives.Regulatory conditions:AB(Customs clearance form for Inbound Goods,Customs clearance form for outbound goods).VAT:17.0%.Tax refund rate:9.0%.MFN tariff:6.5%.general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Regulatory conditions:

    A.Customs clearance form for Inbound Goods
    B.Customs clearance form for outbound goods

    Inspection and quarantine category:

    R.Sanitary supervision and inspection of imported food
    S.Sanitary supervision and inspection of exported food

    Summary:

    HS: 2918290000 other carboxylic acids with phenol function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) VAT:17.0% MFN tariff:6.5% General tariff:30.0%

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Methyl 3,5-dibromo-4-hydroxybenzoate Production Method

Methyl 3,5-dibromo-4-hydroxybenzoate Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:41727-47-3)Methyl 3,5-dibromo-4-hydroxybenzoate
Order Number:A873013
Stock Status:in Stock
Quantity:100g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 09:37
Price ($):176.0

Methyl 3,5-dibromo-4-hydroxybenzoate Related Literature

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Amadis Chemical Company Limited
(CAS:41727-47-3)Methyl 3,5-dibromo-4-hydroxybenzoate
A873013
Purity:99%
Quantity:100g
Price ($):176.0
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