methyl 4-(isothiocyanatomethyl)benzoate

Base Information

Chemical Name:methyl 4-(isothiocyanatomethyl)benzoate
CAS No.:35009-16-6
Molecular Formula:C10H9NO2S
Molecular Weight:207.253
Hs Code.:
Mol file:35009-16-6.mol

Synonyms:Butanoic acid,4-isothiocyanato-,ethyl ester;Ethyl 4-isothiocyanatobutyrate;E-4IB;4-isothiocyanatomethyl-benzoic acid methyl ester;4-isothiocyanato-butyric acid ethyl ester;4-Isothiocyanatobutanoic acid ethyl ester;4-Isothiocyanatomethyl-benzoesaeure-methylester;

Suppliers and Price of methyl 4-(isothiocyanatomethyl)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

Total 4 raw suppliers

Chemical Property of methyl 4-(isothiocyanatomethyl)benzoate

Chemical Property:

Boiling Point:334.7±25.0 °C(Predicted)
PSA：70.75000
Density:1.14±0.1 g/cm3(Predicted)
LogP:2.07600

Purity/Quality:: 99%, ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Technology Process of methyl 4-(isothiocyanatomethyl)benzoate

There total 6 articles about methyl 4-(isothiocyanatomethyl)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: 84.0%

: 75-15-0,12122-00-8
carbon disulfide

: 18469-52-8
methyl 4-(aminomethyl)benzoate

: 35009-16-6
methyl 4-(isothiocyanatomethyl)benzoate

Guidance literature:: carbon disulfide; methyl 4-(aminomethyl)benzoate; With triethylamine; In tetrahydrofuran; at 0 - 20 ℃; for 0.5h; Inert atmosphere;

With acetyl chloride; In tetrahydrofuran; at 0 - 20 ℃; Inert atmosphere;
DOI:10.3390/molecules22060773

Reference yield: 83.0%

: 463-71-8
thiophosgene

: 6232-11-7
methyl 4-(aminomethyl)benzoate hydrochloride

: 35009-16-6
methyl 4-(isothiocyanatomethyl)benzoate

Guidance literature:: With calcium carbonate; In chloroform; water; at 20 ℃; for 16h;
DOI:10.1016/S0968-0896(03)00451-6

Reference yield:

: 876-08-4
p-(chloromethyl)benzoyl chloride

: 35009-16-6
methyl 4-(isothiocyanatomethyl)benzoate

Guidance literature:: Multi-step reaction with 2 steps

1: methanol. NaOH

2: ethanol

With sodium hydroxide; ethanol;
DOI:10.1021/ja01167a097