Isopropyl 2-(4-chlorophenoxy)-2-methylpropanoate

Base Information

• Chemical Name: Isopropyl 2-(4-chlorophenoxy)-2-methylpropanoate
• CAS No.: 64416-88-2
• Molecular Formula: C13H17 Cl O3
• Molecular Weight: 256.73
• DSSTox Substance ID: DTXSID80381783
• Wikidata: Q82172838
• Mol file: 64416-88-2.mol

Synonyms:64416-88-2;isopropyl 2-(4-chlorophenoxy)-2-methylpropanoate;propan-2-yl 2-(4-chlorophenoxy)-2-methylpropanoate;Propanoic acid, 2-(4-chlorophenoxy)-2-methyl-, 1-methylethyl ester;SCHEMBL21992457;DTXSID80381783;5-bromo-4-chloro-3-indolylcaprylate;AKOS017265410;FT-0627468

Chemical Property of Isopropyl 2-(4-chlorophenoxy)-2-methylpropanoate

Chemical Property:

• Vapor Pressure: 0.00044mmHg at 25°C
• Boiling Point: 154 °C
• Flash Point: 115.3°C
• PSA: 35.53000
• Density: 1.124g/cm³
• LogP: 3.44900
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 256.0866221
• Heavy Atom Count: 17
• Complexity: 255

Purity/Quality:

98%min ^*data from raw suppliers

ISOPROPYL 2-(4-CHLOROPHENOXY)-2-METHYLPROPANOATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)OC(=O)C(C)(C)OC1=CC=C(C=C1)Cl