2-Isobutyl-4-methyl-1,3-dioxane

Base Information

• Chemical Name: 2-Isobutyl-4-methyl-1,3-dioxane
• CAS No.: 3080-75-9
• Molecular Formula: C9H18O2
• Molecular Weight: 158.23802
• European Community (EC) Number: 221-372-2
• DSSTox Substance ID: DTXSID30953010
• Nikkaji Number: J217.241K
• Mol file: 3080-75-9.mol

Synonyms:2-Isobutyl-4-methyl-1,3-dioxane;4-methyl-2-(2-methylpropyl)-1,3-dioxane;3080-75-9;EINECS 221-372-2;SCHEMBL7052478;DTXSID30953010;1,3-Dioxane, 4-methyl-2-(2-methylpropyl)-

Chemical Property of 2-Isobutyl-4-methyl-1,3-dioxane

Chemical Property:

• Vapor Pressure: 1.25mmHg at 25°C
• Boiling Point: 179.8°Cat760mmHg
• Flash Point: 60.2°C
• PSA: 18.46000
• Density: 0.881g/cm³
• LogP: 2.18400
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 158.130679813
• Heavy Atom Count: 11
• Complexity: 112

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CCOC(O1)CC(C)C