Cas no 95970-22-2 (1,2-dibromo-3-methoxybenzene)

1,2-dibromo-3-methoxybenzene structure
1,2-dibromo-3-methoxybenzene structure
Product Name:1,2-dibromo-3-methoxybenzene
CAS No:95970-22-2
MF:C7H6Br2O
MW:265.929940700531
MDL:MFCD09864854
CID:1029453
PubChem ID:11958056
Update Time:2024-10-25

1,2-dibromo-3-methoxybenzene Chemical and Physical Properties

Names and Identifiers

    • 1,2-Dibromo-3-methoxybenzene
    • 2,3-DIBROMOANISOLE
    • Benzene, 1,2-dibromo-3-methoxy-
    • AK135817
    • dibromoanisole
    • OR2660
    • CL8946
    • FCH1394389
    • AX8226440
    • 1,2-Dibromo-3-methoxybenzene (ACI)
    • SY104301
    • AKOS015967560
    • 1 pound not2-Dibromo-3-methoxybenzene
    • VDA97022
    • DS-5195
    • DB-337858
    • EN300-1915006
    • 95970-22-2
    • MFCD09864854
    • SCHEMBL7930018
    • DTXSID30474715
    • 1,2-dibromo-3-methoxybenzene
    • MDL: MFCD09864854
    • Inchi: 1S/C7H6Br2O/c1-10-6-4-2-3-5(8)7(6)9/h2-4H,1H3
    • InChI Key: KMUOJHYDIKYRQO-UHFFFAOYSA-N
    • SMILES: BrC1C(Br)=C(OC)C=CC=1

Computed Properties

  • Exact Mass: 265.87649g/mol
  • Monoisotopic Mass: 263.87854g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 108
  • 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: 3.6
  • Topological Polar Surface Area: 9.2

Experimental Properties

  • Boiling Point: 258.8±20.0°C at 760 mmHg

1,2-dibromo-3-methoxybenzene Security Information

1,2-dibromo-3-methoxybenzene Pricemore >>

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1,2-dibromo-3-methoxybenzene Production Method

Production Method 1

Reaction Conditions
1.1 Solvents: Methanol ,  Dimethyl sulfoxide ;  reflux
Reference
Efficient and Complementary Methods Offering Access to Synthetically Valuable 1,2-Dibromobenzenes
Diemer, Vincent; Leroux, Frederic R.; Colobert, Francoise, European Journal of Organic Chemistry, 2011, (2), 327-340

Production Method 2

Reaction Conditions
1.1 Reagents: Sodium methoxide Solvents: Pyridine
Reference
Polybromo aromatic compounds. IV. Methoxydebromination of polybromobenzenes in pyridine
Shishkin, V. N.; Lapin, K. K.; Tanaseichuk, B. S.; Butin, K. P., Zhurnal Organicheskoi Khimii, 1988, 24(3), 577-83

Production Method 3

Reaction Conditions
1.1 Reagents: Sodium nitrite ,  Sulfuric acid Catalysts: Ethanol
Reference
Polybromo-aromatic compounds. III. Synthesis of bromo-substituted anisoles
Shishkin, V. N.; Tanaseichuk, B. S.; Lapin, K. K.; Ivkina, A. A.; Butin, K. P., Zhurnal Organicheskoi Khimii, 1984, 20(12), 2588-99

Production Method 4

Reaction Conditions
Reference
Regioselective halogen-metal exchange reaction of 3-substituted 1,2-dibromo arenes: the synthesis of 2-substituted 5-bromobenzoic acids
Menzel, Karsten; Dimichele, Lisa; Mills, Paul; Frantz, Doug E.; Nelson, Todd D.; et al, Synlett, 2006, (12), 1948-1952

Production Method 5

Reaction Conditions
Reference
Remote Electronic Effects in the Rhodium-Catalyzed Nucleophilic Ring Opening of Oxabenzonorbornadienes
Lautens, Mark; Schmid, Gavin A.; Chau, Anh, Journal of Organic Chemistry, 2002, 67(23), 8043-8053

1,2-dibromo-3-methoxybenzene Raw materials

1,2-dibromo-3-methoxybenzene Preparation Products

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