Cas no 116529-61-4 (3-Bromo-2-nitrobenzoic acid)

3-Bromo-2-nitrobenzoic acid structure
3-Bromo-2-nitrobenzoic acid structure
Product Name:3-Bromo-2-nitrobenzoic acid
CAS No:116529-61-4
MF:C7H4BrNO4
MW:246.014961242676
MDL:MFCD10700064
CID:1089921
PubChem ID:268425
Update Time:2025-04-20

3-Bromo-2-nitrobenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 3-Bromo-2-nitrobenzoic acid
    • 3-Brom-2-nitro-benzoesaeure
    • 3-bromo-2-nitro-benzoic acid
    • Benzoic acid, 3-bromo-2-nitro-
    • 2-Nitro-3-bromobenzoic acid
    • NSC108607
    • CL8995
    • FCH1401157
    • AK141773
    • AX8281914
    • DB-204268
    • AO-801/11702870
    • MFCD10700064
    • DS-7310
    • CS-0060302
    • NSC-108607
    • SY010953
    • AKOS015996106
    • 3-bromo-2-nitrobenzoicacid
    • DTXSID30296272
    • SCHEMBL1161724
    • EN300-175542
    • AKOS022173461
    • 116529-61-4
    • MDL: MFCD10700064
    • Inchi: 1S/C7H4BrNO4/c8-5-3-1-2-4(7(10)11)6(5)9(12)13/h1-3H,(H,10,11)
    • InChI Key: JAURIZJCCFDGDI-UHFFFAOYSA-N
    • SMILES: BrC1=CC=CC(C(=O)O)=C1[N+](=O)[O-]

Computed Properties

  • Exact Mass: 244.93200
  • Monoisotopic Mass: 244.932
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 227
  • 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

Experimental Properties

  • Density: 2.0176 (rough estimate)
  • Boiling Point: 348.6°C at 760 mmHg
  • Flash Point: 164.6°C
  • Refractive Index: 1.6500 (estimate)
  • PSA: 83.12000
  • LogP: 2.57870

3-Bromo-2-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%

3-Bromo-2-nitrobenzoic acid Pricemore >>

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3-Bromo-2-nitrobenzoic acid Production Method

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