Ansofaxine

Base Information

Chemical Name:Ansofaxine
CAS No.:916918-80-4
Molecular Formula:C₂₄H₃₁NO₃
Molecular Weight:381.515
Hs Code.:
UNII:A7CGH459FN
ChEMBL ID:CHEMBL4227736
Metabolomics Workbench ID:155255
NCI Thesaurus Code:C171708
Nikkaji Number:J3.344.293I
Pharos Ligand ID:KRJL1RQ7B5A8
Wikipedia:Ansofaxine

Synonyms:4-(2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl)phenyl 4-methylbenzoate;LPM570065

Suppliers and Price of Ansofaxine

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 1 raw suppliers

Chemical Property of Ansofaxine

Chemical Property:

XLogP3:4.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:381.23039385
Heavy Atom Count:28
Complexity:484

Purity/Quality:: 95% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(CN(C)C)C3(CCCCC3)O
Recent ClinicalTrials:A Relative Bioavailability Food Effect Study of LY03005

Technology Process of Ansofaxine

There total 2 articles about Ansofaxine 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: 55.2%

: 93413-62-8
O-desmethylvenlafaxine

: 874-60-2
4-methyl-benzoyl chloride

: 916918-80-4
4-(2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl)phenyl 4-methylbenzoate

Guidance literature:: With pyridine; In tetrahydrofuran; at 0 ℃; for 5h;

Reference yield:

: 99-94-5
p-Toluic acid

: 916918-80-4
4-(2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl)phenyl 4-methylbenzoate

Guidance literature:: Multi-step reaction with 2 steps

1: thionyl chloride / 3 h / Reflux

2: pyridine / tetrahydrofuran / 6 h / 0 - 20 °C / Inert atmosphere

With pyridine; thionyl chloride; In tetrahydrofuran;
DOI:10.3390/molecules181214920