4-Methyl-2-pentyl-1,3-dioxane

Base Information

• Chemical Name: 4-Methyl-2-pentyl-1,3-dioxane
• CAS No.: 5455-66-3
• Molecular Formula: C10H20O2
• Molecular Weight: 172.2646
• Hs Code.: 2934999090
• NSC Number: 23483
• DSSTox Substance ID: DTXSID80884163
• Nikkaji Number: J421.768C
• Mol file: 5455-66-3.mol

Synonyms:4-Methyl-2-pentyl-1,3-dioxane;5455-66-3;1,3-Dioxane, 4-methyl-2-pentyl-;Hexaldehyde-1,3-butylene glycol acetal;NSC 23483;NSC23483;1, 4-methyl-2-pentyl-;DTXSID80884163;NSC-23483

Chemical Property of 4-Methyl-2-pentyl-1,3-dioxane

Chemical Property:

• Vapor Pressure: 0.333mmHg at 25°C
• Boiling Point: 206.9°Cat760mmHg
• Flash Point: 74.8°C
• PSA: 18.46000
• Density: 0.88g/cm³
• LogP: 2.71820
• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 172.146329876
• Heavy Atom Count: 12
• Complexity: 114

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCC1OCCC(O1)C