Benzene, 1-(bromomethyl)-3,5-dimethoxy-


Chemical Name: Benzene, 1-(bromomethyl)-3,5-dimethoxy-
CAS Number: 877-88-3
Product Number: AG0033JH(AGN-PC-0K2XCR)
Synonyms:
MDL No:
Molecular Formula: C9H11BrO2
Molecular Weight: 231.0864

Identification/Properties


Properties
MP:
69-70 °C(lit.)
BP:
292.1 °C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
231.089g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
229.994g/mol
Monoisotopic Mass:
229.994g/mol
Topological Polar Surface Area:
18.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
118
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H317-H319
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



3,5-Dimethoxybenzyl Bromide, also known as DMBr, is a versatile reagent widely used in organic synthesis. This compound serves as a key building block in the preparation of various biologically active molecules and pharmaceuticals. In chemical synthesis, 3,5-Dimethoxybenzyl Bromide is commonly employed as a benzylating agent, enabling the selective introduction of the 3,5-dimethoxybenzyl group into target molecules. This functional group is valuable for its ability to facilitate further transformations and modifications in the synthesis of complex organic compounds. Additionally, 3,5-Dimethoxybenzyl Bromide is utilized in the preparation of natural products, agrochemicals, and materials science applications. With its versatility and reliability, DMBr plays a crucial role in expanding the possibilities of organic synthesis and drug discovery efforts.