Methyl 2-butyl-2-ethylhexanoate

Base Information

• Chemical Name: Methyl 2-butyl-2-ethylhexanoate
• CAS No.: 106887-88-1
• Molecular Formula: C13H26 O2
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID10698497
• Wikidata: Q82628738
• Mol file: 106887-88-1.mol

Synonyms:106887-88-1;METHYL 2-BUTYL-2-ETHYLHEXANOATE;DTXSID10698497;Hexanoic acid, 2-butyl-2-ethyl-, methyl ester

Chemical Property of Methyl 2-butyl-2-ethylhexanoate

Chemical Property:

• PSA: 26.30000
• LogP: 3.93620
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 9
• Exact Mass: 214.193280068
• Heavy Atom Count: 15
• Complexity: 167

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(CC)(CCCC)C(=O)OC