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

Base Information

• Chemical Name: 2-Benzyl-5-methyl-5-propyl-1,3-dioxane
• CAS No.: 6301-66-2
• Molecular Formula: C15H22O2
• Molecular Weight: 234.33
• European Community (EC) Number: 228-595-4
• NSC Number: 42589
• DSSTox Substance ID: DTXSID30212230
• Nikkaji Number: J206.879F
• Mol file: 6301-66-2.mol

Synonyms:2-Benzyl-5-methyl-5-propyl-1,3-dioxane;6301-66-2;EINECS 228-595-4;NSC42589;1,3-Dioxane, 5-methyl-2-(phenylmethyl)-5-propyl-;DTXSID30212230;NSC 42589;NSC-42589;5-Methyl-2-(phenylmethyl)-5-propyl-1,3-dioxane

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

Chemical Property:

• Vapor Pressure: 0.000797mmHg at 25°C
• Refractive Index: 1.491
• Boiling Point: 315.7 °C at 760 mmHg
• Flash Point: 155.4 °C
• PSA: 18.46000
• Density: 0.979 g/cm³
• LogP: 3.40840
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 234.161979940
• Heavy Atom Count: 17
• Complexity: 213

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC1(COC(OC1)CC2=CC=CC=C2)C