Phenylmethyl N-3-butyn-1-yl-N-(phenylmethyl)carbamate

Base Information

Chemical Name:Phenylmethyl N-3-butyn-1-yl-N-(phenylmethyl)carbamate
CAS No.:107301-62-2
Molecular Formula:C₁₉H₁₉NO₂
Molecular Weight:293.365
Hs Code.:
DSSTox Substance ID:DTXSID801214864
Nikkaji Number:J3.643.525I

Synonyms:DTXSID801214864;107301-62-2;Phenylmethyl N-3-butyn-1-yl-N-(phenylmethyl)carbamate

Suppliers and Price of Phenylmethyl N-3-butyn-1-yl-N-(phenylmethyl)carbamate

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

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Chemical Property of Phenylmethyl N-3-butyn-1-yl-N-(phenylmethyl)carbamate

Chemical Property:

XLogP3:3.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:7
Exact Mass:293.141578849
Heavy Atom Count:22
Complexity:372

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C#CCCN(CC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

Technology Process of Phenylmethyl N-3-butyn-1-yl-N-(phenylmethyl)carbamate

There total 2 articles about Phenylmethyl N-3-butyn-1-yl-N-(phenylmethyl)carbamate 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: 88.0%

: 501-53-1,94274-21-2
benzyl chloroformate

: 107301-61-1
N-benzyl-4-amino-1-butyne

: 107301-62-2
N-benzyl-N-(carbobenzyloxy)-4-amino-1-butyne

Guidance literature:: With sodium hydroxide; In chloroform; water; benzene; for 5h; Ambient temperature;
DOI:10.1021/ja00243a032

Reference yield:

: 100-46-9
benzylamine

: 107301-62-2
N-benzyl-N-(carbobenzyloxy)-4-amino-1-butyne

Guidance literature:: Multi-step reaction with 2 steps

1: 65 percent / triethylamine / dimethylformamide / 10 h / 110 °C

2: 88 percent / NaOH / CHCl₃; benzene; H₂O / 5 h / Ambient temperature

With sodium hydroxide; triethylamine; In chloroform; water; N,N-dimethyl-formamide; benzene;
DOI:10.1021/ja00243a032

Reference yield: 94.0%

: 107301-62-2
N-benzyl-N-(carbobenzyloxy)-4-amino-1-butyne

: (E)-3-benzyl-6-(iodomethylene)-1,3-oxazinan-2-one

Guidance literature:: With iodine; In dichloromethane; at 0 - 20 ℃; for 0.333333h; Reagent/catalyst; stereoselective reaction; Inert atmosphere;
DOI:10.1002/ejoc.201700231