1-Boc-4-Acetamido-4-phenylpiperidine

Base Information

• Chemical Name: 1-Boc-4-Acetamido-4-phenylpiperidine
• CAS No.: 182621-52-9
• Molecular Formula: C18H26N2O3
• Molecular Weight: 318.41
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID30697184
• Wikidata: Q72434688
• Mol file: 182621-52-9.mol

Synonyms:182621-52-9;1-Boc-4-Acetamido-4-phenylpiperidine;tert-butyl 4-acetamido-4-phenylpiperidine-1-carboxylate;SCHEMBL7600715;DTXSID30697184;4-(ACETYLAMINO)-4-PHENYL-1-PIPERIDINECARBOXYLIC ACID TERT-BUTYL ESTER;AKOS016002214;FT-0736735;tert-butyl-4-acetamideo-4-phenylpiperidine-1-carboxylate

Chemical Property of 1-Boc-4-Acetamido-4-phenylpiperidine

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 486.887 °C at 760 mmHg
• Flash Point: 248.261 °C
• PSA: 58.64000
• Density: 1.125 g/cm³
• LogP: 3.37770
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 318.19434270
• Heavy Atom Count: 23
• Complexity: 428

Purity/Quality:

98%min ^*data from raw suppliers

tert-butyl-4-acetamideo-4-phenylpiperidine-1-carboxylate 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1(CCN(CC1)C(=O)OC(C)(C)C)C2=CC=CC=C2

Technology Process of 1-Boc-4-Acetamido-4-phenylpiperidine

There total 4 articles about 1-Boc-4-Acetamido-4-phenylpiperidine 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:

1-phenylmethyl-4-piperidone (3612-20-2) → 4-Acetylamino-4-phenyl-piperidine-1-carboxylic acid tert-butyl ester (182621-52-9)

Guidance literature:

Multi-step reaction with 4 steps

1: 80 percent / tetrahydrofuran

2: 80 percent / H₂SO₄ / acetonitrile

3: H₂ / Pd/C / ethanol

4: TEA / dimethylformamide

With TEA; sulfuric acid; hydrogen; palladium on activated charcoal; In tetrahydrofuran; ethanol; N,N-dimethyl-formamide; acetonitrile;

DOI:10.1016/0960-894X(96)00419-2

Reference yield:

phenyllithium (591-51-5) → 4-Acetylamino-4-phenyl-piperidine-1-carboxylic acid tert-butyl ester (182621-52-9)

Guidance literature:

Multi-step reaction with 4 steps

1: 80 percent / tetrahydrofuran

2: 80 percent / H₂SO₄ / acetonitrile

3: H₂ / Pd/C / ethanol

4: TEA / dimethylformamide

With TEA; sulfuric acid; hydrogen; palladium on activated charcoal; In tetrahydrofuran; ethanol; N,N-dimethyl-formamide; acetonitrile;

DOI:10.1016/0960-894X(96)00419-2

Reference yield:

N-(1-benzyl-4-phenylpiperidin-4-yl)acetamide (172733-78-7) → 4-Acetylamino-4-phenyl-piperidine-1-carboxylic acid tert-butyl ester (182621-52-9)

Guidance literature:

Multi-step reaction with 2 steps

1: H₂ / Pd/C / ethanol

2: TEA / dimethylformamide

With TEA; hydrogen; palladium on activated charcoal; In ethanol; N,N-dimethyl-formamide;

DOI:10.1016/0960-894X(96)00419-2

upstream raw materials:

di-tert-butyl dicarbonate

N-(4-phenylpiperidin-4-yl)acetamide

1-phenylmethyl-4-piperidone

phenyllithium

Downstream raw materials:

(S)-(N)-(1-(3-(1-benzoyl-3(3,4-dichlorophenyl)piperidin-3-yl)propyl)-4-phenylpiperidin-4-yl)-N-methylacetamide

osanetant

4-(Acetyl-methyl-amino)-4-phenyl-piperidine-1-carboxylic acid tert-butyl ester

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