1-Methoxy-3-methyl-d3-benzene

Base Information

Chemical Name:1-Methoxy-3-methyl-d3-benzene
CAS No.:20369-34-0
Molecular Formula:C8H10O
Molecular Weight:125.143
Hs Code.:
DSSTox Substance ID:DTXSID50942527
Wikidata:Q82919547
Mol file:20369-34-0.mol

Synonyms:20369-34-0;1-Methoxy-3-methyl-d3-benzene;1-methoxy-3-(trideuteriomethyl)benzene;3-Methylanisole-d3;Benzene, 1-methoxy-3-(methyl-d3)- (9CI);3-METHOXYTOLUENE-A,A,A-D3;DTXSID50942527;Benzene, 1-methoxy-3-(methyl-d3)-;HY-115127S;1-Methoxy-3-(~2~H_3_)methylbenzene;CS-0621053;3-METHOXYTOLUENE-ALPHA,ALPHA,ALPHA-D3;D99758

Suppliers and Price of 1-Methoxy-3-methyl-d3-benzene

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

Medical Isotopes, Inc.
3-Methoxytoluene-α,α,α-d3
0.5 g
$ 740.00

American Custom Chemicals Corporation
3-METHOXYTOLUENE-ALPHA,ALPHA,ALPHA-D3 95.00%
5MG
$ 504.23

Total 5 raw suppliers

Chemical Property of 1-Methoxy-3-methyl-d3-benzene

Chemical Property:

Vapor Pressure:1.8mmHg at 25°C
Boiling Point:172.2°C at 760 mmHg
Flash Point:54.4°C
PSA：9.23000
Density:0.965g/cm³
LogP:2.00360
XLogP3:2.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:125.091995176
Heavy Atom Count:9
Complexity:80.6

Purity/Quality:

99% by HPLC; 99% atom D ^*data from raw suppliers

3-Methoxytoluene-α,α,α-d3 ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC(=CC=C1)OC
Isomeric SMILES:[2H]C([2H])([2H])C1=CC(=CC=C1)OC
Uses 3-Methoxytoluene-alpha,alpha,alpha-d3 (CAS# 20369-34-0) is a useful isotopically labeled research compound.

Technology Process of 1-Methoxy-3-methyl-d3-benzene

There total 1 articles about 1-Methoxy-3-methyl-d3-benzene 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: 67.5%

: 2398-37-0
3-methoxyphenyl bromide

: 865-50-9
iodomethane-d3

: 20369-34-0
1-methoxy-3-trideuteriomethylbenzene

Guidance literature:: 3-methoxyphenyl bromide; With n-butyllithium; In tetrahydrofuran; at -78 ℃; for 0.5h; Inert atmosphere;

iodomethane-d3; In tetrahydrofuran; at -78 - -10 ℃; for 0.5h;

Reference yield: 75.0%

: 20369-34-0
1-methoxy-3-trideuteriomethylbenzene

: 25026-32-8
3-(2H₃)methylphenol

Guidance literature:: With boron tribromide; In dichloromethane; at -60 - 0 ℃;

Reference yield:

: 20369-34-0
1-methoxy-3-trideuteriomethylbenzene

: 2-[3-(2H₃)methylphenoxymethyl]oxirane

Guidance literature:: Multi-step reaction with 2 steps

1: boron tribromide / dichloromethane / -60 - 0 °C

2: sodium hydroxide / water / 1.5 h / 20 °C

With boron tribromide; sodium hydroxide; In dichloromethane; water;