Cas no 5422-50-4 (Benzene,1-bromo-2-[(2-methylphenoxy)methyl]-)

Benzene,1-bromo-2-[(2-methylphenoxy)methyl]- is a brominated aromatic compound featuring a 2-methylphenoxymethyl substituent. This structure confers reactivity suitable for further functionalization, making it a valuable intermediate in organic synthesis, particularly in pharmaceuticals and agrochemicals. The bromine atom provides a versatile site for nucleophilic substitution or metal-catalyzed cross-coupling reactions, while the methylphenoxy group enhances steric and electronic properties for targeted applications. Its stability under standard conditions ensures ease of handling and storage. The compound’s defined molecular architecture allows for precise modifications, supporting the development of specialized derivatives in research and industrial processes.
Benzene,1-bromo-2-[(2-methylphenoxy)methyl]- structure
5422-50-4 structure
Product Name:Benzene,1-bromo-2-[(2-methylphenoxy)methyl]-
CAS No:5422-50-4
MF:C14H13BrO
MW:277.156423330307
MDL:MFCD07782569
CID:383978
PubChem ID:223552
Update Time:2025-05-27

Benzene,1-bromo-2-[(2-methylphenoxy)methyl]- Chemical and Physical Properties

Names and Identifiers

    • Benzene,1-bromo-2-[(2-methylphenoxy)methyl]-
    • 1-bromo-2-[(2-methylphenoxy)methyl]benzene
    • (2-Brom-benzyl)-o-tolyl-aether
    • (2-bromo-benzyl)-o-tolyl ether
    • 1-bromo-(2-methylphenoxymethyl)benzene
    • 1-bromo-2-[(2-methylphenoxy)methyl]-benzene
    • 2-(2-bromobenzyloxy)-1-toluene
    • 2-(2-methylphenoxymethyl)bromobenzene
    • 2-[(2-methylphenoxy)-methyl]-1-bromo-benzene
    • AC1L5CNA
    • AC1Q26F2
    • AR-1C1935
    • CTK5A0067
    • NSC11287
    • SureCN2292785
    • 2-Bromobenzyl-(2-methylphenyl)ether
    • DTXSID90279107
    • NSC-11287
    • AKOS008951472
    • 1-[(2-BROMOPHENYL)METHOXY]-2-METHYLBENZENE
    • SCHEMBL2292785
    • 1-Bromo-2-((o-tolyloxy)methyl)benzene
    • 5422-50-4
    • OKVTYLOXWGCLBB-UHFFFAOYSA-N
    • MDL： MFCD07782569
    • Inchi： 1S/C14H13BrO/c1-11-6-2-5-9-14(11)16-10-12-7-3-4-8-13(12)15/h2-9H,10H2,1H3
    • InChI Key： OKVTYLOXWGCLBB-UHFFFAOYSA-N
    • SMILES： BrC1C=CC=CC=1COC1C=CC=CC=1C

Computed Properties

  • Exact Mass: 276.01499
  • Monoisotopic Mass: 276.01498g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 207
  • 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: 4.4
  • Topological Polar Surface Area: 9.2?2

Experimental Properties

  • PSA: 9.23
  • LogP: 4.33650

Benzene,1-bromo-2-[(2-methylphenoxy)methyl]- Pricemore >>

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