Pentanoic acid, 5-chloro-3-methyl-5-oxo-, methyl ester

Base Information

• Chemical Name: Pentanoic acid, 5-chloro-3-methyl-5-oxo-, methyl ester
• CAS No.: 56889-46-4
• Molecular Formula: C7H11ClO3
• Molecular Weight: 178.616
• DSSTox Substance ID: DTXSID40447192
• Nikkaji Number: J1.680.139I
• Mol file: 56889-46-4.mol

Synonyms:56889-46-4;Pentanoic acid, 5-chloro-3-methyl-5-oxo-, methyl ester;SCHEMBL287243;DTXSID40447192;3-methyl-4-carbomethoxybutyryl chloride;4-(Chlorocarbonyl)-3-methylbutyric acid methyl ester

Chemical Property of Pentanoic acid, 5-chloro-3-methyl-5-oxo-, methyl ester

Chemical Property:

• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 178.0396719
• Heavy Atom Count: 11
• Complexity: 156

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CC(=O)OC)CC(=O)Cl