(S)-(+)-5-(1-Hydroxy-1-methylethyl)-2-methyl-2-cyclohexen-1-one

Base Information

Chemical Name:(S)-(+)-5-(1-Hydroxy-1-methylethyl)-2-methyl-2-cyclohexen-1-one
CAS No.:60593-11-5
Molecular Formula:C₁₀H₁₆O₂
Molecular Weight:168.236
Hs Code.:2914400090
European Community (EC) Number:622-318-4
ChEMBL ID:CHEMBL4851622
Nikkaji Number:J364.700E
Wikidata:Q76422885
Mol file:60593-11-5.mol

Synonyms:60593-11-5;(5S)-5-(2-HYDROXYPROPAN-2-YL)-2-METHYLCYCLOHEX-2-EN-1-ONE;(S)-(+)-5-(1-Hydroxy-1-methylethyl)-2-methyl-2-cyclohexen-1-one;D-8-Hydroxycarvotanacetone;(S)-8-Hydroxy-p-menth-1-en-6-one;5-(1-Hydroxy-1-methylethyl)-2-methyl-2-cyclohexen-1-one, (S)-;SCHEMBL2746884;CHEMBL4851622;DJOOMNLGIUGRKD-QMMMGPOBSA-N;AKOS015913627

Suppliers and Price of (S)-(+)-5-(1-Hydroxy-1-methylethyl)-2-methyl-2-cyclohexen-1-one

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
(S)-(+)-5-(1-HYDROXY-1-METHYLETHYL)-2-METHYL-2-CYCLOHEXEN-1-ONE 98.00%
5MG
$ 498.33

Total 3 raw suppliers

Chemical Property of (S)-(+)-5-(1-Hydroxy-1-methylethyl)-2-methyl-2-cyclohexen-1-one

Chemical Property:

Vapor Pressure:0.00097mmHg at 25°C
Melting Point:40-42 °C(lit.)
Refractive Index:n20/D 1.507(lit.)
Boiling Point:157-158 °C14 mm Hg(lit.)
PKA:14.74±0.29(Predicted)
Flash Point:>230 °F
PSA：46.53000
Density:1.043 g/mL at 25 °C(lit.)
LogP:1.61840
XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:168.115029749
Heavy Atom Count:12
Complexity:226

Purity/Quality:

98%Min ^*data from raw suppliers

(S)-(+)-5-(1-HYDROXY-1-METHYLETHYL)-2-METHYL-2-CYCLOHEXEN-1-ONE 98.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s): T+
Hazard Codes:T+
Statements: 26/27/28
Safety Statements: 22-36/37/39-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CC1=CCC(CC1=O)C(C)(C)O
Isomeric SMILES:CC1=CC[C@@H](CC1=O)C(C)(C)O

Technology Process of (S)-(+)-5-(1-Hydroxy-1-methylethyl)-2-methyl-2-cyclohexen-1-one

There total 5 articles about (S)-(+)-5-(1-Hydroxy-1-methylethyl)-2-methyl-2-cyclohexen-1-one 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: 65.0%