Carbamic acid, [1-[2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl]-4-piperidinyl]-, phenylmethyl ester

Base Information

Chemical Name:Carbamic acid, [1-[2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl]-4-piperidinyl]-, phenylmethyl ester
CAS No.:182223-55-8
Molecular Formula:C23H25N3O4
Molecular Weight:407.469
Hs Code.:
DSSTox Substance ID:DTXSID201111937
Mol file:182223-55-8.mol

Synonyms:DTXSID201111937;182223-55-8;Carbamic acid, [1-[2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl]-4-piperidinyl]-, phenylmethyl ester

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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 Carbamic acid, [1-[2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl]-4-piperidinyl]-, phenylmethyl ester

Chemical Property:

XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:407.18450629
Heavy Atom Count:30
Complexity:602

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1CN(CCC1NC(=O)OCC2=CC=CC=C2)CCN3C(=O)C4=CC=CC=C4C3=O

Technology Process of Carbamic acid, [1-[2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl]-4-piperidinyl]-, phenylmethyl ester

There total 4 articles about Carbamic acid, [1-[2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethyl]-4-piperidinyl]-, phenylmethyl ester 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: 51.0%

: 574-98-1
2-(2-bromoethyl)isoindoline-1,3-dione

: 207296-89-7
piperidin-4-ylcarbamic acid benzyl ester hydrochloride

: 182223-55-8
{1-[2-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-ethyl]-piperidin-4-yl}-carbamic acid benzyl ester

Guidance literature:: With sodium carbonate; In N,N-dimethyl-formamide; at 100 ℃; for 18h;
DOI:10.1021/jm970857f

Reference yield:

: 50541-93-0
4-amino-1-benzylpiperidine

: 182223-55-8
{1-[2-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-ethyl]-piperidin-4-yl}-carbamic acid benzyl ester

Guidance literature:: Multi-step reaction with 3 steps

1: 65 percent / 1N aq. NaOH / CH₂Cl₂ / 0.33 h / Ambient temperature

2: 1.) 1-chloroethyl chloroformate / 1.) CH₂Cl₂, RT, 1 h, 2.) MeOH, reflux, 1 h

3: 51 percent / Na₂CO₃ / dimethylformamide / 18 h / 100 °C

With sodium hydroxide; carbonochloridic acid 1-chloro-ethyl ester; sodium carbonate; In dichloromethane; N,N-dimethyl-formamide;
DOI:10.1021/jm970857f

Reference yield:

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

: 182223-55-8
{1-[2-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-ethyl]-piperidin-4-yl}-carbamic acid benzyl ester

Guidance literature:: Multi-step reaction with 3 steps

1: 65 percent / 1N aq. NaOH / CH₂Cl₂ / 0.33 h / Ambient temperature

2: 1.) 1-chloroethyl chloroformate / 1.) CH₂Cl₂, RT, 1 h, 2.) MeOH, reflux, 1 h

3: 51 percent / Na₂CO₃ / dimethylformamide / 18 h / 100 °C

With sodium hydroxide; carbonochloridic acid 1-chloro-ethyl ester; sodium carbonate; In dichloromethane; N,N-dimethyl-formamide;
DOI:10.1021/jm970857f