Hexahydro-4-(phenylmethyl)-1,4-oxazepin-6-amine

Base Information

Chemical Name:Hexahydro-4-(phenylmethyl)-1,4-oxazepin-6-amine
CAS No.:170701-99-2
Molecular Formula:C12H18N2O
Molecular Weight:206
Hs Code.:
DSSTox Substance ID:DTXSID301245341
Mol file:170701-99-2.mol

Synonyms:DTXSID301245341;Hexahydro-4-(phenylmethyl)-1,4-oxazepin-6-amine;170701-99-2

Suppliers and Price of Hexahydro-4-(phenylmethyl)-1,4-oxazepin-6-amine

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
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price

Total 1 raw suppliers

Chemical Property of Hexahydro-4-(phenylmethyl)-1,4-oxazepin-6-amine

Chemical Property:

PSA：38.49000
LogP:1.48430
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:206.141913202
Heavy Atom Count:15
Complexity:181

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1COCC(CN1CC2=CC=CC=C2)N

Technology Process of Hexahydro-4-(phenylmethyl)-1,4-oxazepin-6-amine

There total 11 articles about Hexahydro-4-(phenylmethyl)-1,4-oxazepin-6-amine 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: 97.0%

: 170701-91-4
6-(benzyloxycarbonyl)amino-4-benzyl-2,3,4,5,6,7-hexahydro-1,4-oxazepine

: 170701-99-2
4-Benzyl-[1,4]oxazepan-6-ylamine

Guidance literature:: With methanesulfonic acid; In chloroform; for 1h; Heating;
DOI:10.1248/cpb.43.1137

Reference yield:

: 121496-39-7
N-(tert-butoxycarbonyl)-N-benzylethanolamine

: 170701-99-2
4-Benzyl-[1,4]oxazepan-6-ylamine

Guidance literature:: Multi-step reaction with 5 steps

1: 57 percent / BHF*Et₂O / CHCl₃ / 16 h / Ambient temperature

2: 94 percent / HCl / methanol / 6 h / Ambient temperature

3: diisobutylaluminium hydride / toluene / 1 h / -70 °C

4: NaBH₄ / methanol / 16 h / -20 °C

5: 97 percent / MeSO₃H / CHCl₃; various solvent(s) / 1 h / Heating

With hydrogenchloride; sodium tetrahydroborate; methanesulfonic acid; BHF*Et₂O; diisobutylaluminium hydride; In methanol; chloroform; toluene;
DOI:10.1248/cpb.43.1137

Reference yield:

: [2-(2-Benzylamino-ethoxy)-1-formyl-ethyl]-carbamic acid benzyl ester

: 170701-99-2
4-Benzyl-[1,4]oxazepan-6-ylamine

Guidance literature:: Multi-step reaction with 2 steps

1: NaBH₄ / methanol / 16 h / -20 °C

2: 97 percent / MeSO₃H / CHCl₃; various solvent(s) / 1 h / Heating

With sodium tetrahydroborate; methanesulfonic acid; In methanol; chloroform;
DOI:10.1248/cpb.43.1137