Thiocyanic acid, 1-methyl-1-(4-methyl-3-cyclohexen-1-yl)ethyl ester

Base Information

Chemical Name:Thiocyanic acid, 1-methyl-1-(4-methyl-3-cyclohexen-1-yl)ethyl ester
CAS No.:133490-04-7
Molecular Formula:C11H17NS
Molecular Weight:195.329
Hs Code.:
DSSTox Substance ID:DTXSID20471692
Nikkaji Number:J1.931.711K

Synonyms:133490-04-7;Thiocyanic acid, 1-methyl-1-(4-methyl-3-cyclohexen-1-yl)ethyl ester;DTXSID20471692

Suppliers and Price of Thiocyanic acid, 1-methyl-1-(4-methyl-3-cyclohexen-1-yl)ethyl 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 3 raw suppliers

Chemical Property of Thiocyanic acid, 1-methyl-1-(4-methyl-3-cyclohexen-1-yl)ethyl ester

Chemical Property:

XLogP3:3.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:195.10817072
Heavy Atom Count:13
Complexity:257

Purity/Quality:: 98%min ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CCC(CC1)C(C)(C)SC#N

Technology Process of Thiocyanic acid, 1-methyl-1-(4-methyl-3-cyclohexen-1-yl)ethyl ester

There total 3 articles about Thiocyanic acid, 1-methyl-1-(4-methyl-3-cyclohexen-1-yl)ethyl 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: 66.4%

: 39864-10-3
α-terpinyl chloride

: 557-42-6
zinc(II) thiocyanate

: 133490-04-7
α-terpinyl thiocyanate

: 133490-05-8
α-terpinyl isothiocyanate

Guidance literature:: zinc(II) thiocyanate; With titanium tetrachloride; In dichloromethane; for 0.166667h; ultrasound irradiation;

α-terpinyl chloride; With pyridine; In dichloromethane; at 25 ℃; for 6h; ultrasound irradiation;
DOI:10.1081/SCC-120021510

Reference yield:

: 5989-27-5,555-08-8,8022-90-0,9003-73-0,95327-98-3
D-limonene

: 133490-04-7
α-terpinyl thiocyanate

Guidance literature:: Multi-step reaction with 2 steps

1: HCl

2: 45 percent / CH₂Cl₂; pyridine / 8 h / Heating

With hydrogenchloride; In pyridine; dichloromethane; 1: Addition / 2: Substitution;