Cas no 93213-79-7 (3-(Bromomethyl)-1,2-Dichloro-4-Nitrobenzene)

3-(Bromomethyl)-1,2-dichloro-4-nitrobenzene is a halogenated aromatic compound featuring a bromomethyl group, two chloro substituents, and a nitro group on a benzene ring. This structure makes it a versatile intermediate in organic synthesis, particularly for cross-coupling reactions and nucleophilic substitutions. The bromomethyl group offers reactivity for further functionalization, while the electron-withdrawing nitro and chloro groups enhance its utility in electrophilic aromatic substitution and other transformations. Its well-defined reactivity profile and stability under standard conditions make it suitable for pharmaceutical and agrochemical research. The compound is typically handled under controlled conditions due to its potential sensitivity to light and moisture.
3-(Bromomethyl)-1,2-Dichloro-4-Nitrobenzene structure
93213-79-7 structure
Product Name:3-(Bromomethyl)-1,2-Dichloro-4-Nitrobenzene
CAS No:93213-79-7
MF:C7H4BrCl2NO2
MW:284.922159194946
MDL:MFCD22043898
CID:3031594
PubChem ID:18980575
Update Time:2025-10-29

3-(Bromomethyl)-1,2-Dichloro-4-Nitrobenzene Chemical and Physical Properties

Names and Identifiers

    • 2-(Bromomethyl)-3,4-Dichloro-1-Nitrobenzene
    • 93213-79-7
    • AS-67007
    • MFCD22043898
    • SCHEMBL278628
    • CS-0038101
    • DB-202319
    • 3-(bromomethyl)-1,2-dichloro-4-nitrobenzene
    • Benzene, 2-(bromomethyl)-3,4-dichloro-1-nitro-
    • W12313
    • AKOS027256029
    • 3-(Bromomethyl)-1,2-Dichloro-4-Nitrobenzene
    • MDL: MFCD22043898
    • Inchi: 1S/C7H4BrCl2NO2/c8-3-4-6(11(12)13)2-1-5(9)7(4)10/h1-2H,3H2
    • InChI Key: PNXFVIUEJUUQGZ-UHFFFAOYSA-N
    • SMILES: BrCC1C(=C(C=CC=1[N+](=O)[O-])Cl)Cl

Computed Properties

  • Exact Mass: 282.88
  • Monoisotopic Mass: 282.88
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 199
  • 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: 3.5
  • Topological Polar Surface Area: 45.8A^2

Experimental Properties

  • Density: 1.842±0.06 g/cm3(Predicted)
  • Boiling Point: 325.1±37.0 °C(Predicted)

3-(Bromomethyl)-1,2-Dichloro-4-Nitrobenzene Pricemore >>

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