2-(Bromomethyl)-1,3-dimethylbenzene

Base Information

• Chemical Name: 2-(Bromomethyl)-1,3-dimethylbenzene
• CAS No.: 83902-02-7
• Molecular Formula: C9H11Br
• Molecular Weight: 199.09
• Hs Code.: 2903999090
• European Community (EC) Number: 877-918-0
• DSSTox Substance ID: DTXSID90552720
• Nikkaji Number: J1.543.073G
• Wikidata: Q72469482
• Mol file: 83902-02-7.mol

Synonyms:83902-02-7;2,6-Dimethylbenzyl bromide;2-(bromomethyl)-1,3-dimethylbenzene;2,6-Dimethylbenzylbromide;MFCD03844742;Benzene, 2-(bromomethyl)-1,3-dimethyl-;2-Bromomethyl-1,3-dimethyl-benzene;SCHEMBL1072053;DTXSID90552720;PSRARXVEBZQEML-UHFFFAOYSA-N;2-Bromomethyl-1,3-dimethylbenzene;CK1003;AKOS005145532;CS-W005239;DS-1240;SY102337;AM20050092;EN300-226632

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

Chemical Property:

• Vapor Pressure: 0.067mmHg at 25°C
• Melting Point: 37.5-38.5 °C
• Refractive Index: 1.554
• Boiling Point: 237.842 °C at 760 mmHg
• Flash Point: 103.527 °C
• PSA: 0.00000
• Density: 1.314 g/cm³
• LogP: 3.19830
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Solubility.: Chloroform (Slightly)
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 198.00441
• Heavy Atom Count: 10
• Complexity: 90.9

Purity/Quality:

97% ^*data from raw suppliers

2,6-Dimethylbenzylbromide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=CC=C1)C)CBr
• Uses: 2,6-Dimethylbenzyl Bromide is a reactant used in the synthesis of spinosyns which display insecticidal activity. Also used in the preparation of pyridazine derivatives as glutamate transporter EAAT2 activators.

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

There total 6 articles about 2-(Bromomethyl)-1,3-dimethylbenzene 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: 98.0%

2,6-dimethylbenzyl alcohol (62285-58-9) → 2,6-dimethylbenzyl bromide (83902-02-7)

Guidance literature:

With phosphorus tribromide; In dichloromethane; for 16h; Ambient temperature;

DOI:10.1016/S0968-0896(96)00230-1

Reference yield:

C10H14O2S → 2,6-dimethylbenzyl bromide (83902-02-7)

Guidance literature:

With lithium bromide; In dichloromethane; at 0 - 20 ℃; for 2h;

Reference yield:

C10H14O3S → 2,6-dimethylbenzyl bromide (83902-02-7)

Guidance literature:

With lithium bromide; In dichloromethane; at 0 - 20 ℃; for 2h;

upstream raw materials:

2,6-dimethylbenzyl alcohol

2,6-dimethylbenzoic acid

2-Bromo-m-xylene

methyl 2,6-dimethylbenzoate

Downstream raw materials:

2,6-dimethylphenylacetonitrile

2,6-dimethylphenylmethyl-9-fluorenyldimethylammonium bromide

(3R,4R)-4-(3,5-Dimethyl-4-methylene-cyclohexa-2,5-dienyl)-3-phenylsulfanyl-tetrahydro-pyran-2-one

(3S,4R)-4-(2,6-Dimethyl-benzyl)-3-phenylsulfanyl-tetrahydro-pyran-2-one