Methyl 3-(cyanomethoxy)benzoate

Base Information

Chemical Name:Methyl 3-(cyanomethoxy)benzoate
CAS No.:153938-40-0
Molecular Formula:C10H9 N O3
Molecular Weight:191.186
Hs Code.:
DSSTox Substance ID:DTXSID00565361
Nikkaji Number:J2.644.710K
Wikidata:Q82450418
Mol file:153938-40-0.mol

Synonyms:methyl 3-(cyanomethoxy)benzoate;153938-40-0;methyl 3-cyanomethoxybenzoate;SCHEMBL826468;methyl3-(cyanomethoxy)benzoate;NDUSYQITXZHUGU-UHFFFAOYSA-;DTXSID00565361;NDUSYQITXZHUGU-UHFFFAOYSA-N;MFCD04038043;AKOS005209151;LS-08547;InChI=1/C10H9NO3/c1-13-10(12)8-3-2-4-9(7-8)14-6-5-11/h2-4,7H,6H2,1H3

Suppliers and Price of Methyl 3-(cyanomethoxy)benzoate

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

Matrix Scientific
Methyl 3-(cyanomethoxy)benzoate
1g
$ 300.00

Matrix Scientific
Methyl 3-(cyanomethoxy)benzoate
0.500g
$ 240.00

Matrix Scientific
Methyl 3-(cyanomethoxy)benzoate
5g
$ 1000.00

Crysdot
methyl3-(cyanomethoxy)benzoate 95+%
5g
$ 752.00

Total 2 raw suppliers

Chemical Property of Methyl 3-(cyanomethoxy)benzoate

Chemical Property:

PSA：59.32000
LogP:1.37558
XLogP3:2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:191.058243149
Heavy Atom Count:14
Complexity:243

Purity/Quality:

95.0%(GC) ^*data from raw suppliers

Methyl 3-(cyanomethoxy)benzoate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)C1=CC(=CC=C1)OCC#N

Technology Process of Methyl 3-(cyanomethoxy)benzoate

There total 2 articles about Methyl 3-(cyanomethoxy)benzoate 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: 86.0%

: 19438-10-9
methyl 3-hydroxybenzoate

: 590-17-0
cyanomethyl bromide

: 153938-40-0
methyl 3-(cyanomethyloxy)benzoate

Guidance literature:: With potassium carbonate; In acetonitrile; at 60 ℃; for 4h;

Reference yield:

: 19438-10-9
methyl 3-hydroxybenzoate

: 107-14-2
chloroacetonitrile

: 153938-40-0
methyl 3-(cyanomethyloxy)benzoate

Guidance literature:: With sodium hydride; Yield given. Multistep reaction; 1.) DMF, RT, 1 h, 2.) DMF, RT, 3 h;
DOI:10.1016/0223-5234(93)90093-T