2-Ethyl-4-oxo-4H-pyran-3-yl butyrate

Base Information

• Chemical Name: 2-Ethyl-4-oxo-4H-pyran-3-yl butyrate
• CAS No.: 93805-72-2
• Molecular Formula: C11H14 O4
• Molecular Weight: 210.22646
• European Community (EC) Number: 298-555-9
• UNII: BVE6BKQ6L2
• DSSTox Substance ID: DTXSID70239709
• Nikkaji Number: J280.674F
• Mol file: 93805-72-2.mol

Synonyms:2-Ethyl-4-oxo-4H-pyran-3-yl butyrate;93805-72-2;EINECS 298-555-9;(2-ethyl-4-oxopyran-3-yl) butanoate;BVE6BKQ6L2;Butanoic acid, 2-ethyl-4-oxo-4H-pyran-3-yl ester;DTXSID70239709;YVDBHRIILLVEBJ-UHFFFAOYSA-N;2-Ethyl-4-oxo-4H-pyran-3-yl butanoate;NS00039648

Chemical Property of 2-Ethyl-4-oxo-4H-pyran-3-yl butyrate

Chemical Property:

• Vapor Pressure: 0.000111mmHg at 25°C
• Boiling Point: 336.5°Cat760mmHg
• Flash Point: 148.8°C
• PSA: 56.51000
• Density: 1.13g/cm³
• LogP: 1.90770
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 210.08920892
• Heavy Atom Count: 15
• Complexity: 326

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(=O)OC1=C(OC=CC1=O)CC