Cas no 170098-98-3 (1-Bromo-4-fluoro-2-methyl-5-nitrobenzene)

1-Bromo-4-fluoro-2-methyl-5-nitrobenzene structure
170098-98-3 structure
Product Name:1-Bromo-4-fluoro-2-methyl-5-nitrobenzene
CAS No:170098-98-3
MF:C7H5BrFNO2
MW:234.0225045681
MDL:MFCD11110550
CID:1092300
PubChem ID:10036983
Update Time:2025-04-20

1-Bromo-4-fluoro-2-methyl-5-nitrobenzene Chemical and Physical Properties

Names and Identifiers

    • 1-Bromo-4-fluoro-2-methyl-5-nitrobenzene
    • 5-BROMO-2-FLUORO-4-METHYLNITROBENZENE
    • 1-bromo-4-fluoro-2-methyl-5-nitro-benzene
    • 2-bromo-5-fluoro-4-nitro-toluene
    • 2-Bromo-5-fluoro-4-nitrotoluene
    • AK146752
    • KB-82911
    • SureCN601789
    • X8161
    • Benzene, 1-bromo-4-fluoro-2-methyl-5-nitro-
    • 1-Bromo-4-fluoro-2-methyl-5-nitrobenzene, 5-Bromo-2-fluoro-4-methylnitrobenzene
    • VMXDJIHJOUZBAW-UHFFFAOYSA-N
    • PC51134
    • FCH1402694
    • SY039007
    • 2-BROMO-5-FLUORO-4-NITRO TOLUENE
    • AX8284286
    • 2-Bromo-5-fluoro-4-nitrotoluene97%
    • 2-Bromo-5-fluoro-4-nitrotoluene 97%
    • CS-0036275
    • MFCD11110550
    • SCHEMBL601789
    • DB-363467
    • AS-19432
    • AKOS022186987
    • 170098-98-3
    • A904599
    • DTXSID101277251
    • MDL: MFCD11110550
    • Inchi: 1S/C7H5BrFNO2/c1-4-2-6(9)7(10(11)12)3-5(4)8/h2-3H,1H3
    • InChI Key: VMXDJIHJOUZBAW-UHFFFAOYSA-N
    • SMILES: BrC1C=C(C(=CC=1C)F)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 232.94877g/mol
  • Monoisotopic Mass: 232.94877g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 185
  • 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: 45.8
  • XLogP3: 2.9

Experimental Properties

  • Boiling Point: 290.7°C at 760 mmHg

1-Bromo-4-fluoro-2-methyl-5-nitrobenzene Security Information

1-Bromo-4-fluoro-2-methyl-5-nitrobenzene Pricemore >>

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