3-(Bromomethyl)tetrahydrofuran

Base Information

• Chemical Name: 3-(Bromomethyl)tetrahydrofuran
• CAS No.: 165253-29-2
• Molecular Formula: C5H9BrO
• Molecular Weight: 165.03
• Hs Code.: 2932190090
• European Community (EC) Number: 685-743-4
• DSSTox Substance ID: DTXSID60556932
• Mol file: 165253-29-2.mol

Synonyms:3-(Bromomethyl)tetrahydrofuran;165253-29-2;3-(bromomethyl)oxolane;Furan, 3-(bromomethyl)tetrahydro-;TETRAHYDRO-3-FURANYLMETHYL BROMIDE;3-BROMOMETHYL-TETRAHYDRO-FURAN;3-(bromomethyl)-tetrahydrofuran;MFCD08234790;(bromomethyl)tetrahydrofuran;3-Bromomethyltetrahydrofuran;SCHEMBL980734;3-(bromomethyl) tetrahydrofuran;DTXSID60556932;AXQYVOIYCYAVSW-UHFFFAOYSA-N;AKOS009306992;CS-W004268;PB10518;BS-12718;SY042030;AM20080466;EN300-57097;A20788;A910446;J-524868;F8880-3165

Chemical Property of 3-(Bromomethyl)tetrahydrofuran

Chemical Property:

• Vapor Pressure: 1.064mmHg at 25°C
• Refractive Index: n20/D1.494
• Boiling Point: 183.217oC at 760 mmHg
• Flash Point: 71.444oC
• PSA: 9.23000
• Density: 1.448g/cm3
• LogP: 1.41780
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 163.98368
• Heavy Atom Count: 7
• Complexity: 56

Purity/Quality:

98%,99%, ^*data from raw suppliers

3-(Bromomethyl)oxolane ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 22-36
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1COCC1CBr
• Uses: 3-(Bromomethyl)oxolane is used as a reagent in the preparation of thiazoleurea derivatives for use as antitumor agents.

Technology Process of 3-(Bromomethyl)tetrahydrofuran

There total 4 articles about 3-(Bromomethyl)tetrahydrofuran 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: 86.77%

(tetrahydrofuran-3-yl)methyl methanesulfonate (184849-49-8) → 3-(bromomethyl)oxolane (165253-29-2)

Guidance literature:

With lithium bromide; In acetone; for 3h; Heating / reflux;

Reference yield: 62.0%

3-tetrahydrofuranmethanol (124391-75-9,124506-31-6,15833-61-1) → 3-(bromomethyl)oxolane (165253-29-2)

Guidance literature:

With carbon tetrabromide; triphenylphosphine; In dichloromethane; at 0 - 20 ℃; for 2h;

Reference yield:

3-(chloromethyl)tetrahydrofuran (89181-22-6) → 3-(bromomethyl)oxolane (165253-29-2)

Guidance literature:

With lithium bromide; In acetone; at 20 ℃; for 20h; Heating / reflux;

upstream raw materials:

(tetrahydrofuran-3-yl)methyl methanesulfonate

carbon tetrabromide

3-tetrahydrofuranmethanol

3-(chloromethyl)tetrahydrofuran

Downstream raw materials:

3-{2-[5-chloro-2-(tetrahydrofuran-3-ylmethoxy)phenyl]-5-methyl-pyrrol-1-yl}-benzoic acid

5-(2-(3,4-dimethoxyphenyl)propan-2-yl)-1-(4-fluorophenyl)-2-((2-((tetrahydrofuran-3-yl) methoxy)ethyl)thio)-1H-imidazole

4-(1-(3-(trifluoromethyl)phenyl)-2,5-dioxo-3-((tetrahydrofuran-3-yl)methyl)-1,2,3,4,5,6,7,8-octahydroquinazolin-4-yl)benzonitrile

C₁₃H₁₆O₃

Refernces

• 1、 -. "TRI-SUBSTITUTED ARYL AND HETEROARYL DERIVATIVES AS MODULATORS OF PI3-KINASE AND AUTOPHAGY PATHWAYS". Paragraph 0216. . Retrieved 2019/11/04.
• 2、 -. "NEW INDANYLOXYDIHYDROBENZOFURANYLACETIC ACID DERIVATIVES AND THEIR USE AS GPR40 RECEPTOR AGONISTS". Page/Page column 74. . Retrieved 2013/10/21.