2-Phenylazepane-1-carbaldehyde

Base Information

Chemical Name:2-Phenylazepane-1-carbaldehyde
CAS No.:71602-41-0
Molecular Formula:C13H17NO
Molecular Weight:203.284
Hs Code.:
DSSTox Substance ID:DTXSID00499778

Synonyms:2-Phenylazepane-1-carbaldehyde;71602-41-0;SCHEMBL8540149;DTXSID00499778;HUIYGUCNCWYBNY-UHFFFAOYSA-N;1-Formyl-2-(R,S)-phenylazacycloheptane

Suppliers and Price of 2-Phenylazepane-1-carbaldehyde

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 2-Phenylazepane-1-carbaldehyde

Chemical Property:

XLogP3:2.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:203.131014166
Heavy Atom Count:15
Complexity:199

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1CCC(N(CC1)C=O)C2=CC=CC=C2

Technology Process of 2-Phenylazepane-1-carbaldehyde

There total 3 articles about 2-Phenylazepane-1-carbaldehyde 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: 96.0%

: 1542147-52-3
C₁₃H₁₅NO

: 71602-41-0
1-Formyl-2-(R,S)-phenylazacycloheptane

Guidance literature:: With palladium 10% on activated carbon; In ethyl acetate; at 24 ℃; for 22h; Inert atmosphere;
DOI:10.1021/ol403671s

Reference yield:

: 24740-68-9
7-chloro-2,3,4,5-tetrahydro-1H-azepine-1-carbaldehyde

: 71602-41-0
1-Formyl-2-(R,S)-phenylazacycloheptane

Guidance literature:: Multi-step reaction with 2 steps

1: triethylamine; bis-triphenylphosphine-palladium(II) chloride / N,N-dimethyl-formamide / 18 h / 24 °C / Inert atmosphere

2: palladium 10% on activated carbon / ethyl acetate / 22 h / 24 °C / Inert atmosphere

With bis-triphenylphosphine-palladium(II) chloride; palladium 10% on activated carbon; triethylamine; In ethyl acetate; N,N-dimethyl-formamide; 1: |Suzuki Coupling;
DOI:10.1021/ol403671s