Thiocyanatoacetic acid methyl ester

Base Information

Chemical Name:Thiocyanatoacetic acid methyl ester
CAS No.:689-77-0
Molecular Formula:C4H5NO2S
Molecular Weight:131.155
Hs Code.:2930909090
NSC Number:4092
UNII:T6602L6PQD
DSSTox Substance ID:DTXSID90218975
Nikkaji Number:J54.973H
Wikidata:Q83095878
Mol file:689-77-0.mol

Synonyms:Thiocyanatoacetic acid methyl ester;689-77-0;methyl thiocyanatoacetate;ACETIC ACID, THIOCYANATO-, METHYL ESTER;methyl thiocyanoacetate;Thiocyano-essigsaeure-methyl-ester;NSC 4092;BRN 1751314;Thiocyano-essigsaeure-methyl-ester [German];T6602L6PQD;NSC-4092;Acetic acid, 2-thiocyanato-, methyl ester;C4H5NO2S;methyl 2-thiocyanatoacetate;Methyl=thiocyanoacetate;WLN: NCS1VO1;UNII-T6602L6PQD;SCHEMBL6397282;DTXSID90218975;NSC4092

Suppliers and Price of Thiocyanatoacetic acid methyl ester

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 7 raw suppliers

Chemical Property of Thiocyanatoacetic acid methyl ester

Chemical Property:

Vapor Pressure:0.165mmHg at 25°C
Boiling Point:213.3°C at 760 mmHg
Flash Point:82.8°C
PSA：75.39000
Density:1.244g/cm³
LogP:0.37368
XLogP3:0.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:131.00409958
Heavy Atom Count:8
Complexity:125

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)CSC#N

Technology Process of Thiocyanatoacetic acid methyl ester

There total 4 articles about Thiocyanatoacetic acid methyl ester 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:

: 333-20-0
potassium thioacyanate

: 96-34-4
methyl chloroacetate

: 689-77-0
α-thiocyanato-acetic acid methyl ester

Guidance literature:: With ethanol;

Reference yield:

: 105-45-3
acetoacetic acid methyl ester

: 689-77-0
α-thiocyanato-acetic acid methyl ester

Guidance literature:: With hydrogenchloride; dihydrogen peroxide; und Behandeln des Reaktionsprodukts mit einer aus Kupfer(I)-thiocyanat, Ammoniumthiocyanat und Wasser bereiteten Loesung;