Cyclohexanone, 2-(1-mercapto-1-methylethyl)-5-methyl-, (2S-trans)-

Base Information

Chemical Name:Cyclohexanone, 2-(1-mercapto-1-methylethyl)-5-methyl-, (2S-trans)-
CAS No.:33281-91-3
Molecular Formula:C₁₀H₁₈OS
Molecular Weight:186.318
Hs Code.:
UNII:K6Q2TQU7QS
Nikkaji Number:J110.051C
Mol file:33281-91-3.mol

Synonyms:35117-85-2;K6Q2TQU7QS;p-Mentha-8-thiol-3-one, trans-;5-Methyl-2-(1-methyl-1-sulfanylethyl)cyclohexanone #;SCHEMBL15368049;RVOKNSFEAOYULQ-YUMQZZPRSA-N;trans-8-mercapto-p-menthan-3-one;AKOS006328362;8-MERCAPTO-P-MENTHAN-3-ONE, TRANS-;5alpha-Methyl-2beta-(1-mercapto-1-methylethyl)cyclohexanone;(2S,5S)-2-(1-Mercapto-1-methylethyl)-5-methylcyclohexanone;Cyclohexanone, 2-(1-mercapto-1-methylethyl)-5-methyl-, (2S-trans)-;Cyclohexanone, 2-(1-mercapto-2-methylethyl)-5-methyl-, (2S-trans)-;CYCLOHEXANONE, 2-(1-MERCAPTO-1-METHYLETHYL)-5-METHYL-, (2R,5R)-REL-

Suppliers and Price of Cyclohexanone, 2-(1-mercapto-1-methylethyl)-5-methyl-, (2S-trans)-

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
TRANS-2-(1-MERCAPTO-1-METHYLETHYL)-5-METHYLCYCLOHEXAN-1-ONE 95.00%
5MG
$ 501.97

Total 5 raw suppliers

Chemical Property of Cyclohexanone, 2-(1-mercapto-1-methylethyl)-5-methyl-, (2S-trans)-

Chemical Property:

Vapor Pressure:0.00585mmHg at 25°C
Boiling Point:273.1°Cat760mmHg
Flash Point:108.3°C
PSA：55.87000
Density:0.997g/cm³
LogP:2.70010
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:186.10783637
Heavy Atom Count:12
Complexity:186

Purity/Quality:

99% ^*data from raw suppliers

TRANS-2-(1-MERCAPTO-1-METHYLETHYL)-5-METHYLCYCLOHEXAN-1-ONE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1CCC(C(=O)C1)C(C)(C)S
Isomeric SMILES:C[C@H]1CC[C@@H](C(=O)C1)C(C)(C)S

Technology Process of Cyclohexanone, 2-(1-mercapto-1-methylethyl)-5-methyl-, (2S-trans)-

There total 13 articles about Cyclohexanone, 2-(1-mercapto-1-methylethyl)-5-methyl-, (2S-trans)- 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: 67.5%

: 89-82-7,90449-51-7
pulegone

: 185017-87-2,33284-96-7,33281-91-3
2-(1-mercapto-1-methylethyl)-5-methylcyclohexanone

Guidance literature:: With sodium polysulfide; In ethanol; at 80 ℃; for 12h; Solvent; Temperature;

Reference yield: 65.0%

: 3391-90-0,90449-51-7
(S)-(-)-pulegone

: 33284-96-7,33281-91-3
2-(1-mercapto-1-methylethyl)-5-methyl-cyclohexanone

Guidance literature:: With sodium sulfide; zinc(II) chloride; In methanol; at 60 - 70 ℃; for 15h;

Reference yield:

: 94293-57-9
8-acetylthio-para-menthan-3-one

: 38462-22-5,33284-96-7,33281-91-3
2-(1-mercapto-1-methylethyl)-5-methylcyclohexanone

Guidance literature:: With Passiflora edulis wall-bound hydrolase; at 30 ℃; pH=7.2; aq. phosphate buffer; Enzymatic reaction;
DOI:10.1021/jf800793q