4-Methyl-5-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepine

Base Information

Chemical Name:4-Methyl-5-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepine
CAS No.:46861-37-4
Molecular Formula:C16H17NO
Molecular Weight:239.317
Hs Code.:
DSSTox Substance ID:DTXSID00529443
Mol file:46861-37-4.mol

Synonyms:46861-37-4;4-Methyl-5-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepine;DTXSID00529443

Suppliers and Price of 4-Methyl-5-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepine

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 0 raw suppliers

Chemical Property of 4-Methyl-5-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepine

Chemical Property:

XLogP3:3.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:239.131014166
Heavy Atom Count:18
Complexity:262

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1CCOC2=CC=CC=C2C1C3=CC=CC=C3

Technology Process of 4-Methyl-5-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepine

There total 4 articles about 4-Methyl-5-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepine 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: 67.0%

: 89718-94-5
4-Methyl-5-phenyl-2,3-dihydro-benzo[f][1,4]oxazepin-4-ium; iodide

: 46861-37-4
4-methyl-5-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepine

Guidance literature:: With sodium tetrahydroborate; In methanol; ethanol; water; for 2.5h;

Reference yield:

: 26965-62-8
7-chloro-4-methyl-5-phenyl-4,5-dihydro-benzo[f][1,4]oxazepin-3-one

: 46861-37-4
4-methyl-5-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepine

Guidance literature:: With lithium aluminium tetrahydride; In tetrahydrofuran; for 7.5h; Heating;
DOI:10.1021/jo00801a013

Reference yield:

: 26965-61-7
7-chloro-5-phenyl-4,5-dihydro-benzo[f][1,4]oxazepin-3-one

: 46861-37-4
4-methyl-5-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepine

Guidance literature:: Multi-step reaction with 2 steps

1: NaH / toluene / 7 h / Heating

2: LiAlH₄ / tetrahydrofuran / 7.5 h / Heating

With lithium aluminium tetrahydride; sodium hydride; In tetrahydrofuran; toluene;
DOI:10.1021/jo00801a013