1,16-Hexadecanedithiol

Base Information

• Chemical Name: 1,16-Hexadecanedithiol
• CAS No.: 79028-45-8
• Molecular Formula: C16H34 S2
• Molecular Weight: 290.57116
• European Community (EC) Number: 636-056-3
• DSSTox Substance ID: DTXSID80512070
• Nikkaji Number: J1.054.629J
• Wikidata: Q82371158
• Mol file: 79028-45-8.mol

Synonyms:1,16-HEXADECANEDITHIOL;79028-45-8;hexadecane-1,16-dithiol;1,16-HEXADECANEDITHIOL, 99%;SCHEMBL439422;1,16-Hexadecanedithiol,99%;DTXSID80512070;AKOS015856601;AS-81190

Chemical Property of 1,16-Hexadecanedithiol

Chemical Property:

• Melting Point: 48-52 °C
• Refractive Index: 1.4841 (estimate)
• Boiling Point: 402.64°C (estimate)
• Flash Point: 110 °C
• PSA: 77.60000
• Density: 0.9560 (estimate)
• LogP: 6.30740
• Storage Temp.: 2-8°C
• XLogP3: 7.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 15
• Exact Mass: 290.21019343
• Heavy Atom Count: 18
• Complexity: 121

Purity/Quality:

98%,99%, ^*data from raw suppliers

1,16-Hexadecanedithiol 99% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CCCCCCCCS)CCCCCCCS
• Uses: Long chain dithiol for SAMs in sensors.1 HDDT forms a SAM on gold nanoparticle for potential usage in biosensors and other biological applications.