2-[(2-Cyclohexyl-1-nitroethyl)sulfanyl]pyridine

Base Information

Chemical Name:2-[(2-Cyclohexyl-1-nitroethyl)sulfanyl]pyridine
CAS No.:104543-10-4
Molecular Formula:C13H18N2O2S
Molecular Weight:266.364
Hs Code.:
DSSTox Substance ID:DTXSID60530752
Mol file:104543-10-4.mol

Synonyms:104543-10-4;2-[(2-Cyclohexyl-1-nitroethyl)sulfanyl]pyridine;DTXSID60530752

Suppliers and Price of 2-[(2-Cyclohexyl-1-nitroethyl)sulfanyl]pyridine

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 2-[(2-Cyclohexyl-1-nitroethyl)sulfanyl]pyridine

Chemical Property:

XLogP3:4.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:266.10889899
Heavy Atom Count:18
Complexity:264

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCC(CC1)CC([N+](=O)[O-])SC2=CC=CC=N2

Technology Process of 2-[(2-Cyclohexyl-1-nitroethyl)sulfanyl]pyridine

There total 2 articles about 2-[(2-Cyclohexyl-1-nitroethyl)sulfanyl]pyridine 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: 70.0%

: 3638-64-0,26618-70-2
1-nitroethylene

: 105398-69-4
Cyclohexanecarboxylic acid 2-thioxo-2H-pyridin-1-yl ester

: 104543-10-4
2-cyclohexyl-1-nitro-1-(pyridine-2-thiyl)ethane

Guidance literature:: With camphor-10-sulfonic acid; In benzene; at -20 - -10 ℃; for 0.5h; Irradiation;
DOI:10.1016/S0040-4020(01)91351-1

Reference yield:

: 1121-30-8
1-hydroxy-2(1H)-pyridinethione

: 104543-10-4
2-cyclohexyl-1-nitro-1-(pyridine-2-thiyl)ethane

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) oxalylchloride, DMF, 2.) pyridine / 1.) benzene, overnight, RT 2.) benzene, 30 min, RT

2: 70 percent / camphor sulphonic acid / benzene / 0.5 h / -20 - -10 °C / Irradiation

With pyridine; Chloro-oxo-acetic acid; camphor-10-sulfonic acid; N,N-dimethyl-formamide; In benzene;
DOI:10.1016/S0040-4020(01)91351-1

Reference yield: 89.0%

: 104543-10-4
2-cyclohexyl-1-nitro-1-(pyridine-2-thiyl)ethane

: 5292-21-7
Cyclohexylacetic acid

Guidance literature:: With dihydrogen peroxide; potassium carbonate; In tetrahydrofuran; methanol; at 40 ℃; for 15h;
DOI:10.1016/S0040-4020(01)91351-1