4,4,6-Trimethyl-alpha-propyl-1,3-dioxane-2-propanol

Base Information

• Chemical Name: 4,4,6-Trimethyl-alpha-propyl-1,3-dioxane-2-propanol
• CAS No.: 68568-80-9
• Molecular Formula: C13H26O3
• Molecular Weight: 230.3437
• European Community (EC) Number: 271-502-7
• DSSTox Substance ID: DTXSID90887468
• Nikkaji Number: J309.222D
• Mol file: 68568-80-9.mol

Synonyms:68568-80-9;4,4,6-Trimethyl-alpha-propyl-1,3-dioxane-2-propanol;EINECS 271-502-7;2-(3-Hydroxyhexyl)-4,4,6-trimethyl-1,3-dioxane;1,3-Dioxane-2-propanol, 4,4,6-trimethyl-.alpha.-propyl-;1,3-Dioxane-2-propanol, 4,4,6-trimethyl-alpha-propyl-;DTXSID90887468;1-Propyl-3-(4,4,6-trimethyl-1,3-dioxan-2-yl)-1-propanol

Chemical Property of 4,4,6-Trimethyl-alpha-propyl-1,3-dioxane-2-propanol

Chemical Property:

• Boiling Point: 304.1°Cat760mmHg
• Flash Point: 149.7°C
• PSA: 166.12000
• Density: 0.927g/cm³
• LogP: 2.96060
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 230.18819469
• Heavy Atom Count: 16
• Complexity: 203

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(CCC1OC(CC(O1)(C)C)C)O