(S)-(+)-1-Cyclohexylethyl isothiocyanate

Base Information

Chemical Name:(S)-(+)-1-Cyclohexylethyl isothiocyanate
CAS No.:737000-92-9
Molecular Formula:C9H15NS
Molecular Weight:169.28700
Hs Code.:2930909090
European Community (EC) Number:679-436-4
DSSTox Substance ID:DTXSID00468065
Mol file:737000-92-9.mol

Synonyms:(S)-(+)-1-Cyclohexylethyl isothiocyanate;737000-92-9;[(1S)-1-isothiocyanatoethyl]cyclohexane;DTXSID00468065;MFCD05664050;AKOS025295674;BP-12888

Suppliers and Price of (S)-(+)-1-Cyclohexylethyl isothiocyanate

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

SynQuest Laboratories
(S)-(+)-1-Cyclohexylethylisothiocyanate
1 g
$ 183.00

Apolloscientific
(S)-(+)-1-Cyclohexylethylisothiocyanate
1g
$ 166.00

American Custom Chemicals Corporation
(S)-(+)-1-CYCLOHEXYLETHYL ISOTHIOCYANATE 95.00%
1G
$ 143.00

Alfa Aesar
(S)-(+)-1-Cyclohexylethyl isothiocyanate, 97%
1g
$ 64.60

Total 3 raw suppliers

Chemical Property of (S)-(+)-1-Cyclohexylethyl isothiocyanate

Chemical Property:

Refractive Index:1.5268
PSA：44.45000
Density:1,004 g/cm3
LogP:3.05800
Sensitive.:Moisture Sensitive
XLogP3:4.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:169.09252066
Heavy Atom Count:11
Complexity:155

Purity/Quality:

99% ^*data from raw suppliers

(S)-(+)-1-Cyclohexylethylisothiocyanate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:
Statements: 20/21/22-36/37/38
Safety Statements: 26-36/37/39

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C1CCCCC1)N=C=S
Isomeric SMILES:C[C@@H](C1CCCCC1)N=C=S

Technology Process of (S)-(+)-1-Cyclohexylethyl isothiocyanate

There total 1 articles about (S)-(+)-1-Cyclohexylethyl isothiocyanate 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: 66.0%

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

: 17430-98-7
[(1S)-1-cyclohexylethyl]amine

: 737000-92-9
((S)-1-Isothiocyanato-ethyl)-cyclohexane

Guidance literature:: With dicyclohexyl-carbodiimide; In diethyl ether; at -10 - 20 ℃; for 15h;
DOI:10.1002/ejoc.200500420

Reference yield:

: 737000-92-9
((S)-1-Isothiocyanato-ethyl)-cyclohexane

: 1-((S)-1-Cyclohexyl-ethyl)-3-((1S,2S)-2-{[1-(1H-imidazol-2-yl)-meth-(E)-ylidene]-amino}-cyclohexyl)-thiourea

Guidance literature:: Multi-step reaction with 2 steps

1: CH₂Cl₂ / 3 h / 20 °C

2: 100 percent / Na₂SO₄ / methanol / 2 h / 20 °C

With sodium sulfate; In methanol; dichloromethane;
DOI:10.1002/ejoc.200500420