1-Methoxyundecane-3-thiol

Base Information

• Chemical Name: 1-Methoxyundecane-3-thiol
• CAS No.: 94201-22-6
• Molecular Formula: C12H26OS
• Molecular Weight: 218.39924
• European Community (EC) Number: 303-606-6
• DSSTox Substance ID: DTXSID90916141
• Nikkaji Number: J382.425J
• Mol file: 94201-22-6.mol

Synonyms:1-Methoxyundecane-3-thiol;94201-22-6;EINECS 303-606-6;3-Undecanethiol,1-methoxy-;1-Methoxy-3-undecanethiol;DTXSID90916141

Chemical Property of 1-Methoxyundecane-3-thiol

Chemical Property:

• Vapor Pressure: 0.00563mmHg at 25°C
• Refractive Index: 1.455
• Boiling Point: 282.8 °C at 760 mmHg
• Flash Point: 124.8 °C
• PSA: 48.03000
• Density: 0.882 g/cm³
• LogP: 4.07190
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 10
• Exact Mass: 218.17043662
• Heavy Atom Count: 14
• Complexity: 107

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC(CCOC)S