Cas no 100958-94-9 (2-METHYL-3,5-DIBROMOBENZOIC ACID)

2-METHYL-3,5-DIBROMOBENZOIC ACID structure
100958-94-9 structure
Product Name:2-METHYL-3,5-DIBROMOBENZOIC ACID
CAS No:100958-94-9
MF:C8H6Br2O2
MW:293.940041065216
MDL:MFCD09749956
CID:840358
PubChem ID:17838930
Update Time:2025-04-19

2-METHYL-3,5-DIBROMOBENZOIC ACID Chemical and Physical Properties

Names and Identifiers

    • 2-METHYL-3,5-DIBROMOBENZOIC ACID
    • 3,5-Dibromo-2-methylbenzoic acid
    • 100958-94-9
    • E77162
    • ZEZXVIRBOFKOMW-UHFFFAOYSA-N
    • MFCD09749956
    • CS-0161175
    • Benzoic acid, 3,5-dibromo-2-methyl-
    • DB-058542
    • DTXSID20591203
    • AKOS017553088
    • BS-51992
    • SCHEMBL2226763
    • MDL： MFCD09749956
    • Inchi： 1S/C8H6Br2O2/c1-4-6(8(11)12)2-5(9)3-7(4)10/h2-3H,1H3,(H,11,12)
    • InChI Key： ZEZXVIRBOFKOMW-UHFFFAOYSA-N
    • SMILES： BrC1=CC(=CC(C(=O)O)=C1C)Br

Computed Properties

  • Exact Mass: 291.87338
  • Monoisotopic Mass: 291.87345g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 184
  • 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: 3.2
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • PSA: 37.3

2-METHYL-3,5-DIBROMOBENZOIC ACID Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
M301230-1mg
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SHANG HAI XIAN DING Biotechnology Co., Ltd.
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1PlusChem
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