Carbonic acid, 2-(3-oxo-3-(2-oxocyclopentyl)propyl)-1,4-phenylene diethyl ester

Base Information

• Chemical Name: Carbonic acid, 2-(3-oxo-3-(2-oxocyclopentyl)propyl)-1,4-phenylene diethyl ester
• CAS No.: 51943-99-8
• Molecular Formula: C20H24 O8
• Molecular Weight: 392.39976
• European Community (EC) Number: 257-536-5
• DSSTox Substance ID: DTXSID80966271
• Nikkaji Number: J294.955E
• Mol file: 51943-99-8.mol

Synonyms:51943-99-8;EINECS 257-536-5;Diethyl 2-(3-oxo-3-(2-oxocyclopentyl)propyl)-p-phenylene dicarbonate;2-(3-(2,5-Bis((ethoxycarbonyl)oxy)phenyl-1-oxopropyl)cyclopentanone;Carbonic acid, 2-(3-oxo-3-(2-oxocyclopentyl)propyl)-1,4-phenylene diethyl ester;Carbonic acid, 2-[3-oxo-3-(2-oxocyclopentyl)propyl]-1,4-phenylene diethyl ester;Carbonic acid, C,C'-(2-(3-oxo-3-(2-oxocyclopentyl)propyl)-1,4-phenylene) C,C'-diethyl ester;Diethyl 2-[3-oxo-3-(2-oxocyclopentyl)propyl]-p-phenylene dicarbonate;DTXSID80966271;3-[2,5-Bis(ethoxycarbonyloxy)phenyl]-1-(2-oxocyclopentyl)-1-propanone;Diethyl 2-[3-oxo-3-(2-oxocyclopentyl)propyl]-1,4-phenylene biscarbonate

Chemical Property of Carbonic acid, 2-(3-oxo-3-(2-oxocyclopentyl)propyl)-1,4-phenylene diethyl ester

Chemical Property:

• Vapor Pressure: 3.7E-12mmHg at 25°C
• Boiling Point: 550.3°Cat760mmHg
• PKA: 10.67±0.20(Predicted)
• Flash Point: 239.8°C
• PSA: 105.20000
• Density: 1.247g/cm³
• LogP: 3.62810
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 12
• Exact Mass: 392.14711772
• Heavy Atom Count: 28
• Complexity: 573

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)OC1=CC(=C(C=C1)OC(=O)OCC)CCC(=O)C2CCCC2=O