Phenyl N-cyclopentylcarbamate

Base Information

• Chemical Name: Phenyl N-cyclopentylcarbamate
• CAS No.: 58713-31-8
• Molecular Formula: C12H15NO2
• Molecular Weight: 205.257
• DSSTox Substance ID: DTXSID10509973
• Wikidata: Q82367951
• Mol file: 58713-31-8.mol

Synonyms:Phenyl N-cyclopentylcarbamate;58713-31-8;CYCLOPENTYL-CARBAMIC ACID PHENYL ESTER;Phenyl cyclopentylcarbamate;SCHEMBL5115600;DTXSID10509973;QQUHFUIRBALNSV-UHFFFAOYSA-N;AKOS008932607

Chemical Property of Phenyl N-cyclopentylcarbamate

Chemical Property:

• Vapor Pressure: 0.001mmHg at 25°C
• Refractive Index: 1.551
• Boiling Point: 302.076°C at 760 mmHg
• Flash Point: 136.491°C
• PSA: 38.33000
• Density: 1.13g/cm³
• LogP: 3.10850
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 205.110278721
• Heavy Atom Count: 15
• Complexity: 206

Purity/Quality:

99% ^*data from raw suppliers

CYCLOPENTYL-CARBAMIC ACID PHENYL ESTER 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(C1)NC(=O)OC2=CC=CC=C2

Technology Process of Phenyl N-cyclopentylcarbamate

There total 1 articles about Phenyl N-cyclopentylcarbamate 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: 81.0%

phenyl chloroformate (1885-14-9) + Cyclopentamine (1003-03-8) → Phenyl N-cyclopentylcarbamate (58713-31-8)

Guidance literature:

With pyridine; In tetrahydrofuran; at 0 - 20 ℃; for 24.58h;

Reference yield: 57.0%

Phenyl N-cyclopentylcarbamate (58713-31-8) + chlorocarbonyl isocyanate (27738-96-1) → O-phenyl N-cyclopentyl-N-isocyanato-carbonyl-carbamate (84942-55-2)

Guidance literature:

In chlorobenzene; at 130 ℃; for 1.5h;

Reference yield:

Phenyl N-cyclopentylcarbamate (58713-31-8) + (S)-N-[[3-[3-fluoro-4-(1-piperazinyl)phenyl]-2-oxo-5-oxazolidinyl]methyl]acetamide (154590-66-6,154590-43-9) → C22H30FN5O4 (1010409-03-6)

Guidance literature:

In dimethyl sulfoxide;

DOI:10.1016/j.bmcl.2007.09.024

upstream raw materials:

phenyl chloroformate

Cyclopentamine

Downstream raw materials:

O-phenyl N-cyclopentyl-N-isocyanato-carbonyl-carbamate

C₂₂H₃₀FN₅O₄

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