2-Hexyl-5-methyl-5-propyl-1,3-dioxane

Base Information

• Chemical Name: 2-Hexyl-5-methyl-5-propyl-1,3-dioxane
• CAS No.: 7081-83-6
• Molecular Formula: C14H28 O2
• Molecular Weight: 228.37092
• European Community (EC) Number: 230-380-5
• NSC Number: 41980
• DSSTox Substance ID: DTXSID80221074
• Nikkaji Number: J227.370E
• Mol file: 7081-83-6.mol

Synonyms:2-Hexyl-5-methyl-5-propyl-1,3-dioxane;7081-83-6;EINECS 230-380-5;AI3-31948;1,3-Dioxane, 2-hexyl-5-methyl-5-propyl-;NSC41980;DTXSID80221074;NSC 41980;NSC-41980

Chemical Property of 2-Hexyl-5-methyl-5-propyl-1,3-dioxane

Chemical Property:

• Vapor Pressure: 0.0136mmHg at 25°C
• Boiling Point: 267.2°C at 760 mmHg
• Flash Point: 105.7°C
• PSA: 18.46000
• Density: 0.862g/cm³
• LogP: 4.13610
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 7
• Exact Mass: 228.208930132
• Heavy Atom Count: 16
• Complexity: 172

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCC1OCC(CO1)(C)CCC