Cas no 856380-98-8 (1-(Benzyloxy)-2,4-dibromobenzene)

1-(Benzyloxy)-2,4-dibromobenzene structure
856380-98-8 structure
Product Name:1-(Benzyloxy)-2,4-dibromobenzene
CAS No:856380-98-8
MF:C13H10Br2O
MW:342.025902271271
MDL:MFCD06657289
CID:1083494
PubChem ID:53419174
Update Time:2024-10-26

1-(Benzyloxy)-2,4-dibromobenzene Chemical and Physical Properties

Names and Identifiers

    • 1-(Benzyloxy)-2,4-dibromobenzene
    • 4-Benzyloxy-1,3-dibromobenzene
    • 2,4-Dibromo-1-(phenylmethoxy)benzene (ACI)
    • Ether, benzyl 2,4-dibromophenyl (5CI)
    • 2,4-dibromo-1-phenylmethoxybenzene
    • SCHEMBL7898169
    • DB-362948
    • BENZYL (2,4-DIBROMO-PHENYL) ETHER
    • 856380-98-8
    • MFCD06657289
    • AKOS022181336
    • 1-Benzyloxy-2,4-dibromo-benzene
    • CS-0322318
    • MDL: MFCD06657289
    • Inchi: 1S/C13H10Br2O/c14-11-6-7-13(12(15)8-11)16-9-10-4-2-1-3-5-10/h1-8H,9H2
    • InChI Key: XETLZFWWVYNKJM-UHFFFAOYSA-N
    • SMILES: BrC1C=C(Br)C(OCC2C=CC=CC=2)=CC=1

Computed Properties

  • Exact Mass: 341.908
  • Monoisotopic Mass: 339.91
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 204
  • 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: 9.2A^2
  • XLogP3: 4.8

Experimental Properties

  • Density: 1.7±0.1 g/cm3
  • Boiling Point: 381.3±27.0 °C at 760 mmHg
  • Flash Point: 156.6±22.2 °C
  • Vapor Pressure: 0.0±0.8 mmHg at 25°C

1-(Benzyloxy)-2,4-dibromobenzene Security Information

1-(Benzyloxy)-2,4-dibromobenzene Pricemore >>

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1-(Benzyloxy)-2,4-dibromobenzene Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Iodobenzene diacetate ,  Lithium bromide Solvents: 2,2,2-Trifluoroethanol ;  1 h, rt
Reference
Dehydroxymethyl Bromination of Alkoxybenzyl Alcohols by Using a Hypervalent Iodine Reagent and Lithium Bromide
Shibata, Ayako; et al, Synlett, 2018, 29(17), 2275-2278

Production Method 2

Reaction Conditions
1.1 Reagents: Potassium carbonate Solvents: Dimethylformamide ;  1.3 h, rt
1.2 Solvents: Water ;  rt
Reference
Concise and modular synthesis of regioisomeric haptens for the production of high-affinity and stereoselective antibodies to the strobilurin azoxystrobin
Parra, Javier; et al, Tetrahedron, 2011, 67(3), 624-635

1-(Benzyloxy)-2,4-dibromobenzene Raw materials

1-(Benzyloxy)-2,4-dibromobenzene Preparation Products

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