Cas no 868-36-0 (2-bromo-1,1-dimethoxybutane)

2-Bromo-1,1-dimethoxybutane is a brominated acetal compound commonly used as an intermediate in organic synthesis. Its structure features a reactive bromine substituent, making it a valuable reagent for nucleophilic substitution reactions, particularly in the preparation of more complex molecules. The dimethoxy groups enhance stability while maintaining reactivity under controlled conditions. This compound is particularly useful in pharmaceutical and agrochemical research, where selective functionalization is required. Its liquid state at room temperature facilitates handling and precise dosing in laboratory settings. Proper storage under inert conditions is recommended to preserve its reactivity and prevent degradation.
2-bromo-1,1-dimethoxybutane structure
2-bromo-1,1-dimethoxybutane structure
Product Name:2-bromo-1,1-dimethoxybutane
CAS No:868-36-0
MF:C6H13BrO2
MW:197.070221662521
MDL:MFCD19707392
CID:660427
PubChem ID:11106292
Update Time:2025-10-29

2-bromo-1,1-dimethoxybutane Chemical and Physical Properties

Names and Identifiers

    • Butane, 2-bromo-1,1-dimethoxy-
    • 2-bromo-1,1-dimethoxybutane
    • SCHEMBL6180838
    • EN300-248255
    • 2-bromo-1,1-dimethoxy-butane
    • 868-36-0
    • DTXSID30455387
    • MDL： MFCD19707392
    • Inchi： 1S/C6H13BrO2/c1-4-5(7)6(8-2)9-3/h5-6H,4H2,1-3H3
    • InChI Key： OXJUWNGIXKTRMK-UHFFFAOYSA-N
    • SMILES： BrC(CC)C(OC)OC

Computed Properties

  • Exact Mass: 196.00989g/mol
  • Monoisotopic Mass: 196.00989g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 4
  • Complexity: 64.1
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.8
  • Topological Polar Surface Area: 18.5?2

2-bromo-1,1-dimethoxybutane Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
EN300-248255-0.05g
2-bromo-1,1-dimethoxybutane
 868-36-0 95%
0.05g
 $174.0 2024-06-19
Enamine
EN300-248255-0.1g
2-bromo-1,1-dimethoxybutane
 868-36-0 95%
0.1g
 $257.0 2024-06-19
Enamine
EN300-248255-0.25g
2-bromo-1,1-dimethoxybutane
 868-36-0 95%
0.25g
 $367.0 2024-06-19
Enamine
EN300-248255-0.5g
2-bromo-1,1-dimethoxybutane
 868-36-0 95%
0.5g
 $579.0 2024-06-19
Enamine
EN300-248255-1.0g
2-bromo-1,1-dimethoxybutane
 868-36-0 95%
1.0g
 $743.0 2024-06-19
Enamine
EN300-248255-2.5g
2-bromo-1,1-dimethoxybutane
 868-36-0 95%
2.5g
 $1454.0 2024-06-19
Enamine
EN300-248255-5.0g
2-bromo-1,1-dimethoxybutane
 868-36-0 95%
5.0g
 $2152.0 2024-06-19
Enamine
EN300-248255-10.0g
2-bromo-1,1-dimethoxybutane
 868-36-0 95%
10.0g
 $3191.0 2024-06-19
1PlusChem
1P004J7H-50mg
Butane, 2-bromo-1,1-dimethoxy-
 868-36-0 95%
50mg
 $263.00 2025-02-21
1PlusChem
1P004J7H-100mg
Butane, 2-bromo-1,1-dimethoxy-
 868-36-0 95%
100mg
 $363.00 2025-02-21

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