1-(2-Chloro-6-fluorophenyl)-1-cyclopentanecarboxylate

Base Information

• Chemical Name: 1-(2-Chloro-6-fluorophenyl)-1-cyclopentanecarboxylate
• CAS No.: 214263-03-3
• Molecular Formula: C12H12 Cl F O2
• Molecular Weight: 242.67
• DSSTox Substance ID: DTXSID30943996
• Wikidata: Q72451165
• Mol file: 214263-03-3.mol

Synonyms:DTXSID30943996;A815334;1-(2-chloro-6-fluorophenyl)-1-cyclopentanecarboxylate;1-(2-Chloro-6-fluorophenyl)cyclopentane-1-carboxylatato;1-(2-chloro-6-fluoro-phenyl)cyclopentanecarboxylate;1-(2-Chloro-6-fluorophenyl)cyclopentanecarboxylic Acid

Chemical Property of 1-(2-Chloro-6-fluorophenyl)-1-cyclopentanecarboxylate

Chemical Property:

• Vapor Pressure: 4.45E-06mmHg at 25°C
• Melting Point: 124°C
• Boiling Point: 368.4°Cat760mmHg
• Flash Point: 176.6°C
• PSA: 37.30000
• Density: g/cm³
• LogP: 3.37550
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 241.0431604
• Heavy Atom Count: 16
• Complexity: 271

Purity/Quality:

99.3% ^*data from raw suppliers

1-(2-Chloro-6-fluorophenyl)cyclopentanecarboxylicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(C1)(C2=C(C=CC=C2Cl)F)C(=O)[O-]