Cas no 107650-20-4 (5-Bromo-2-methyl-3-nitrobenzoic Acid)

5-Bromo-2-methyl-3-nitrobenzoic Acid structure
107650-20-4 structure
Product Name:5-Bromo-2-methyl-3-nitrobenzoic Acid
CAS No:107650-20-4
MF:C8H6BrNO4
MW:260.041541576386
MDL:MFCD07357316
CID:94730
PubChem ID:13770008
Update Time:2025-04-18

5-Bromo-2-methyl-3-nitrobenzoic Acid Chemical and Physical Properties

Names and Identifiers

    • 5-Bromo-2-methyl-3-nitrobenzoic acid
    • AKOS BB-9545
    • Benzoic acid, 5-broMo-2-Methyl-3-nitro-
    • 5-bromo-2-methyl-3-nitrobenzoicacid
    • 5-bromo-2-methyl-3-nitro-benzoic acid
    • KSC496G3H
    • DXUUJILVHXQDCV-UHFFFAOYSA-N
    • CL8125
    • TRA0085089
    • 5-bromo-2-methyl-3-nitro benzoic acid
    • Benzoic
    • Benzoic acid,5-bromo-2-methyl-3-nitro-
    • AM802901
    • MFCD07357316
    • FT-0689789
    • AC-7359
    • EN300-83395
    • 107650-20-4
    • SB40580
    • SY005907
    • DTXSID10548948
    • AKOS015996112
    • SCHEMBL2591086
    • DS-1165
    • AKOS004120998
    • J-516967
    • CS-M2396
    • DB-014378
    • 5-Bromo-2-methyl-3-nitrobenzoic Acid
    • MDL: MFCD07357316
    • Inchi: 1S/C8H6BrNO4/c1-4-6(8(11)12)2-5(9)3-7(4)10(13)14/h2-3H,1H3,(H,11,12)
    • InChI Key: DXUUJILVHXQDCV-UHFFFAOYSA-N
    • SMILES: BrC1C=C(C(C)=C(C(=O)O)C=1)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 258.94800
  • Monoisotopic Mass: 258.94802g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 252
  • 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
  • Topological Polar Surface Area: 83.1
  • XLogP3: 2.3

Experimental Properties

  • Color/Form: No data avaiable
  • Density: 1.1±0.1 g/cm3
  • Melting Point: 185-190°C
  • Boiling Point: 230.5±15.0 °C at 760 mmHg
  • Flash Point: 181.793℃
  • Refractive Index: 1.633
  • PSA: 83.12000
  • LogP: 2.88710
  • Vapor Pressure: 0.1±0.5 mmHg at 25°C

5-Bromo-2-methyl-3-nitrobenzoic Acid Security Information

5-Bromo-2-methyl-3-nitrobenzoic Acid Customs Data

  • HS CODE:2916399090
  • Customs Data:

    China Customs Code:

    2916399090

    Overview:

    2916399090 Other aromatic monocarboxylic acids. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, Acrylic acid\Acrylates or esters shall be packaged clearly

    Summary:

    2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

5-Bromo-2-methyl-3-nitrobenzoic Acid Pricemore >>

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5-Bromo-2-methyl-3-nitrobenzoic Acid Production Method

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