Aprikalim

Base Information

Chemical Name:Aprikalim
CAS No.:89544-10-5
Deprecated CAS:135912-05-9,143680-26-6
Molecular Formula:C12H16N2OS2
Molecular Weight:268.3982
Hs Code.:
Nikkaji Number:J366.286A
NCI Thesaurus Code:C77145
Mol file:89544-10-5.mol

Synonyms:aprikalim;N-methyl-2-(3-pyridyl)tetrahydrothiopyran-2-carbothioamide-1-oxide;RP 49356;RP 52891;RP-49356;RP-52891

Suppliers and Price of Aprikalim

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

American Custom Chemicals Corporation
APRIKALIM 95.00%
5MG
$ 497.70

Total 3 raw suppliers

Chemical Property of Aprikalim

Chemical Property:

Vapor Pressure:7.02E-10mmHg at 25°C
Boiling Point:493.5°Cat760mmHg
Flash Point:252.2°C
PSA：100.33000
Density:1.32g/cm³
LogP:3.03330
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:268.07040549
Heavy Atom Count:17
Complexity:322

Purity/Quality:

99% ^*data from raw suppliers

APRIKALIM 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CNC(=S)C1(CCCCS1=O)C2=CN=CC=C2
Isomeric SMILES:CNC(=S)[C@@]1(CCCCS1=O)C2=CN=CC=C2

Technology Process of Aprikalim

There total 8 articles about Aprikalim 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: 56.0%

: 89544-09-2,143620-07-9,143620-14-8
cis-methyl 2-(3-pyridyl)tetrahydrothiopyran-2-carbodithioate 1-oxide

: 74-89-5
methylamine

: 89544-10-5,92569-65-8,132562-26-6,135912-05-9,137623-39-3,143680-24-4,143680-27-7
cis-N-methyl-2-(3-pyridyl)tetrahydrothiopyran-2-carbothioamide 1-oxide

Guidance literature:: In ethanol; for 2h;
DOI:10.1021/jm00098a004

Reference yield: 40.0%

: 89544-09-2,143620-07-9,143620-14-8
(1R,2R)-1-Oxo-2-pyridin-3-yl-hexahydro-1λ⁴-thiopyran-2-carbodithioic acid methyl ester

: 74-89-5
methylamine

: 89544-10-5,92569-65-8,132562-26-6,135912-05-9,137623-39-3,143680-24-4,143680-27-7
RP 49356

Guidance literature:: In ethanol; at 25 ℃; for 2h;
DOI:10.1021/jm00098a004

Reference yield:

: 89544-20-7
methyl 2-(3-pyridyl)tetrahydrothiopyran-2-carbodithioate

: 89544-10-5,92569-65-8,132562-26-6,135912-05-9,137623-39-3,143680-24-4,143680-27-7
RP 49356

Guidance literature:: Multi-step reaction with 2 steps

1: 58 percent / m-chloroperoxybenzoic acid / CH₂Cl₂ / 20 °C

2: 40 percent / ethanol / 2 h / 25 °C

With 3-chloro-benzenecarboperoxoic acid; In ethanol; dichloromethane;
DOI:10.1021/jm00098a004