Bis(1,3-dimethylbutyl) phosphonate

Base Information

• Chemical Name: Bis(1,3-dimethylbutyl) phosphonate
• CAS No.: 13086-86-7
• Molecular Formula: C₁₂H₂₇O₃P
• Molecular Weight: 250.318
• European Community (EC) Number: 235-997-3
• DSSTox Substance ID: DTXSID70864358,DTXSID701252338
• Mol file: 13086-86-7.mol

Synonyms:Bis(1,3-dimethylbutyl) phosphonate;13086-86-7;Phosphonic acid, bis(1,3-dimethylbutyl) ester;bis(4-methylpentan-2-yloxy)-oxophosphanium;EINECS 235-997-3;BIS-(1,3-DIMETHYLBUTYL) PHOSPHONATE;SCHEMBL2898520;DTXSID70864358;DTXSID701252338;Bis-(1,3-dimethylbutyl)phosphonate;Bis[(4-methylpentan-2-yl)oxy](oxo)phosphanium

Chemical Property of Bis(1,3-dimethylbutyl) phosphonate

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 59.00000
• Density: g/cm³
• LogP: 4.27850
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 8
• Exact Mass: 249.16195668
• Heavy Atom Count: 16
• Complexity: 184

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)CC(C)O[P+](=O)OC(C)CC(C)C