4,4,7-Trimethyl-4,4a,5,6,7,8-hexahydronaphthalen-2(3h)-one

Base Information

Chemical Name:4,4,7-Trimethyl-4,4a,5,6,7,8-hexahydronaphthalen-2(3h)-one
CAS No.:92101-12-7
Molecular Formula:C₁₃H₂₀O
Molecular Weight:192.301
Hs Code.:
NSC Number:140611
DSSTox Substance ID:DTXSID20301026

Synonyms:92101-12-7;4,4,7-trimethyl-4,4a,5,6,7,8-hexahydronaphthalen-2(3h)-one;NSC140611;DTXSID20301026;NSC-140611

Suppliers and Price of 4,4,7-Trimethyl-4,4a,5,6,7,8-hexahydronaphthalen-2(3h)-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

Total 6 raw suppliers

Chemical Property of 4,4,7-Trimethyl-4,4a,5,6,7,8-hexahydronaphthalen-2(3h)-one

Chemical Property:

Vapor Pressure:0.00227mmHg at 25°C
Boiling Point:288.9°Cat760mmHg
Flash Point:124°C
Density:0.97g/cm³
XLogP3:3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:0
Exact Mass:192.151415257
Heavy Atom Count:14
Complexity:286

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1CCC2C(=CC(=O)CC2(C)C)C1

Technology Process of 4,4,7-Trimethyl-4,4a,5,6,7,8-hexahydronaphthalen-2(3h)-one

There total 9 articles about 4,4,7-Trimethyl-4,4a,5,6,7,8-hexahydronaphthalen-2(3h)-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: 52.0%

: 541-50-4
2-acetoacetic acid

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

: 70855-67-3,92101-12-7,95120-22-2
(7R)-4,4,7-trimethyl-4,4a,5,6,7,8-hexahydronaphthalen-2(3H)-one

Guidance literature:: 2-acetoacetic acid; pulegone; With copper(II) bis(trifluoromethanesulfonate); at 20 ℃; for 12h; Inert atmosphere;

With toluene-4-sulfonic acid; In tetrahydrofuran; at 20 ℃; Inert atmosphere;
DOI:10.1021/acs.orglett.8b00607

Reference yield:

: 10191-25-0
3-oxo-valeric acid

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

: C₁₃H₂₂O₂

: 70855-67-3,92101-12-7,95120-22-2
(7R)-4,4,7-trimethyl-4,4a,5,6,7,8-hexahydronaphthalen-2(3H)-one

Guidance literature:: With copper(II) bis(trifluoromethanesulfonate); In neat (no solvent); at 20 ℃; for 12h; Inert atmosphere;
DOI:10.1021/acs.orglett.8b00607