2-(Bromomethyl)-1,3-dioxane

Base Information

Chemical Name:2-(Bromomethyl)-1,3-dioxane
CAS No.:5695-63-6
Molecular Formula:C5H9BrO2
Molecular Weight:181.029
Hs Code.:2934999090
NSC Number:193315
DSSTox Substance ID:DTXSID50307591
Nikkaji Number:J1.054.869A
Wikidata:Q82055039
Mol file:5695-63-6.mol

Synonyms:2-(bromomethyl)-1,3-dioxane;5695-63-6;2-bromomethyl-1,3-dioxane;NSC193315;SCHEMBL4996500;DTXSID50307591;QAURNRYFMGYNRF-UHFFFAOYSA-N;AKOS006287462;NSC-193315

Suppliers and Price of 2-(Bromomethyl)-1,3-dioxane

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
2-(Bromomethyl)-1,3-dioxane
0.25g
$ 155.00

Total 6 raw suppliers

Chemical Property of 2-(Bromomethyl)-1,3-dioxane

Chemical Property:

Vapor Pressure:0.364mmHg at 25°C
Boiling Point:205.1°C at 760 mmHg
Flash Point:81.3°C
PSA：18.46000
Density:1.474g/cm³
LogP:1.14430
XLogP3:1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:179.97859
Heavy Atom Count:8
Complexity:61.4

Purity/Quality:

95% ^*data from raw suppliers

2-(Bromomethyl)-1,3-dioxane ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1COC(OC1)CBr
Uses 2-(Bromomethyl)-1,3-dioxane is synthesized from the catalytic effect of crown ethers on the bromination of 2-methyl-1,3-dioxacycloalkanes with N-bromosuccinimide.

Technology Process of 2-(Bromomethyl)-1,3-dioxane

There total 2 articles about 2-(Bromomethyl)-1,3-dioxane which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 93.0%

: 626-68-6
2-methyl-[1,3]dioxane

: 5695-63-6
1,3-dioxan-2-ylmethyl bromide

Guidance literature:: With bromine; di-tert-butyldicyclohexano-18-crown-18; In benzene; at 20 ℃; for 0.166667h;

Reference yield:

: 626-68-6
2-methyl-[1,3]dioxane

: 5695-63-6
1,3-dioxan-2-ylmethyl bromide

: 592-33-6
3-bromopropyl acetate

Guidance literature:: With N-Bromosuccinimide; In tetrachloromethane; at 40 ℃; Title compound not separated from byproducts; other temp. (70 deg C);
DOI:10.1007/BF00507238