2,11-Dimethyl-2,11-dipropyl-1,12-dodecanediol

Base Information

• Chemical Name: 2,11-Dimethyl-2,11-dipropyl-1,12-dodecanediol
• CAS No.: 85018-69-5
• Molecular Formula: C20H42O2
• Molecular Weight: 314.5463
• DSSTox Substance ID: DTXSID901005359
• Mol file: 85018-69-5.mol

Synonyms:2,11-Dimethyl-2,11-dipropyl-1,12-dodecanediol;85018-69-5;1,12-Dodecanediol, 2,11-dimethyl-2,11-dipropyl-;2,11-dimethyl-2,11-dipropyldodecane-1,12-diol;SCHEMBL11089992;DTXSID901005359;LS-63457

Chemical Property of 2,11-Dimethyl-2,11-dipropyl-1,12-dodecanediol

Chemical Property:

• Vapor Pressure: 1.3E-08mmHg at 25°C
• Boiling Point: 414.7°Cat760mmHg
• PKA: 14.93±0.10(Predicted)
• Flash Point: 172.2°C
• PSA: 40.46000
• Density: 0.889g/cm³
• LogP: 5.70460
• XLogP3: 7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 15
• Exact Mass: 314.318480578
• Heavy Atom Count: 22
• Complexity: 228

Purity/Quality:

99%min ^*data from raw suppliers

1,12-DODECANEDIOL, 2,11-DIMETHYL-2,11-DIPROPYL- 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(C)(CCCCCCCCC(C)(CCC)CO)CO