3-Cyclopentylpropionyl chloride

Base Information

• Chemical Name: 3-Cyclopentylpropionyl chloride
• CAS No.: 104-97-2
• Molecular Formula: C8H13ClO
• Molecular Weight: 160.644
• Hs Code.: 2916209090
• European Community (EC) Number: 203-257-9
• DSSTox Substance ID: DTXSID00146210
• Nikkaji Number: J182.188A
• Wikidata: Q72460525
• Mol file: 104-97-2.mol

Synonyms:104-97-2;3-Cyclopentylpropionyl chloride;3-cyclopentylpropanoyl chloride;Cyclopentylpropionyl chloride;Cyclopentanepropionyl chloride;3-cyclopentylpropionylchloride;3-Cyclopentyl propionyl chloride;EINECS 203-257-9;3-cyclopentyl propoyl chloride;Cyclopentanepropanoyl-chloride-;Cyclopentylpropionylchlorid;3-cyclopentylpropionylchlorid;Cyclopentanepropanoyl chloride;cyclopentane propionyl chloride;SCHEMBL279341;3-cyclopentanpropionyl chloride;3-Cyclopentyl propionylchloride;3-(cyclopentyl)propanoyl chloride;DTXSID00146210;3-Cyclopentylpropanoic acid chloride;Cyclopentanepropionyl chloride, 98%;BBL027339;MFCD00001391;STL146446;AKOS005720835;FD10555;VS-08527;FT-0615578;A801121;W-108798;F2190-0023

Chemical Property of 3-Cyclopentylpropionyl chloride

Chemical Property:

• Appearance/Colour: light yellow liquid
• Vapor Pressure: 0.34mmHg at 25°C
• Refractive Index: n20/D 1.464(lit.)
• Boiling Point: 199.499 °C at 760 mmHg
• Flash Point: 84.444 °C
• PSA: 17.07000
• Density: 1.062 g/cm³
• LogP: 2.72220
• Sensitive.: Moisture Sensitive
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 160.0654927
• Heavy Atom Count: 10
• Complexity: 116

Purity/Quality:

99% ^*data from raw suppliers

3-Cyclopentylpropionyl Chloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C
• Statements: 34-37
• Safety Statements: 26-36/37/39-45-27

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(C1)CCC(=O)Cl
• Uses: 3-Cyclopentylpropionyl Chloride is an synthetic intermediate in the synthesis of new family of type 3 17β-Hydroxysteroid dehydrogenase inhibitors. Cyclopentanepropionyl chloride was used in the synthesis of 3-cyclopentylpropanamido)methylboronic acid.

Technology Process of 3-Cyclopentylpropionyl chloride

There total 3 articles about 3-Cyclopentylpropionyl chloride 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: 100.0%

3-cyclopentylpropionic acid (140-77-2) → cyclopentanepropanoyl chloride (104-97-2)

Guidance literature:

With thionyl chloride; In toluene; Heating;

DOI:10.1016/j.ejmech.2005.02.011

Reference yield:

oxalyl dichloride (79-37-8) + 3-cyclopentylpropionic acid (140-77-2) → cyclopentanepropanoyl chloride (104-97-2)

Guidance literature:

In dichloromethane;

Reference yield:

→ cyclopentanepropanoyl chloride (104-97-2)

Guidance literature:

upstream raw materials:

3-cyclopentylpropionic acid

oxalyl dichloride

Downstream raw materials:

N-[3-(3-Cyclopentyl-propionylamino)-phenyl]-2,2-dimethyl-propionamide

3-cyclopentyl-1-propanol

(3-bromo-propyl)-cyclopentane

5-cyclopentylpentan-1-ol

Refernces

• 1、 Hu, Qu-Ping,Cheng, Jing,Wang, Ying,Shi, Jie,Wang, Bi-Qin,Hu, Ping,Zhao, Ke-Qing,Pan, Fei. "Remote Regioselective Radical C-H Functionalization of Unactivated C-H Bonds in Amides: The Synthesis of gem-Difluoroalkenes". . p. 4457 - 4462. Retrieved 2021.
• 2、 -. "Cationic lipid compound, composition containing same and application". Paragraph 0103. . Retrieved 2021/06/22.