Piperidine, 1-(2-isocyano-1-oxo-3-phenylpropyl)-

Base Information

Chemical Name:Piperidine, 1-(2-isocyano-1-oxo-3-phenylpropyl)-
CAS No.:85059-38-7
Molecular Formula:C15H18N2O
Molecular Weight:242.321
Hs Code.:
DSSTox Substance ID:DTXSID00476509
Nikkaji Number:J1.832.430J

Synonyms:85059-38-7;Piperidine, 1-(2-isocyano-1-oxo-3-phenylpropyl)-;2-isocyano-3-phenyl-1-piperidin-1-ylpropan-1-one;DTXSID00476509;AKOS015955056

Suppliers and Price of Piperidine, 1-(2-isocyano-1-oxo-3-phenylpropyl)-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of Piperidine, 1-(2-isocyano-1-oxo-3-phenylpropyl)-

Chemical Property:

XLogP3:2.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:242.141913202
Heavy Atom Count:18
Complexity:319

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:[C-]#[N+]C(CC1=CC=CC=C1)C(=O)N2CCCCC2

Technology Process of Piperidine, 1-(2-isocyano-1-oxo-3-phenylpropyl)-

There total 6 articles about Piperidine, 1-(2-isocyano-1-oxo-3-phenylpropyl)- 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%

: 120301-86-2
N-(1-Benzyl-2-oxo-2-piperidin-1-yl-ethyl)-formamide

: 85059-38-7
2-isocyano-3-phenyl-1-(piperidin-1-yl)propan-1-one

Guidance literature:: With triethylamine; trichlorophosphate; In dichloromethane; at 0 - 20 ℃; for 1h;

Reference yield:

: 4289-95-6
N-formyl-phenylalanine

: 85059-38-7
2-isocyano-3-phenyl-1-(piperidin-1-yl)propan-1-one

Guidance literature:: Multi-step reaction with 2 steps

1: benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine / dichloromethane / 24 h / 20 °C

2: triethylamine; trichlorophosphate / dichloromethane / 3 h / -30 °C

With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; trichlorophosphate; In dichloromethane;
DOI:10.1021/acs.orglett.9b02242

Reference yield:

: 150-30-1,25191-15-5,658-69-5,67675-33-6
Phenylalanine

: 85059-38-7
2-isocyano-3-phenyl-1-(piperidin-1-yl)propan-1-one

Guidance literature:: Multi-step reaction with 3 steps

1: acetic anhydride / 1 h / 0 - 20 °C

2: benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine / dichloromethane / 24 h / 20 °C

3: triethylamine; trichlorophosphate / dichloromethane / 3 h / -30 °C

With acetic anhydride; benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; trichlorophosphate; In dichloromethane;
DOI:10.1021/acs.orglett.9b02242