5244-34-8
Product Name:
3,6-Dithia-1,8-octanediol
Formula:
C6H14O2S2
Synonyms:
2,2′-(Ethylenedithio)diethanol;Lindlar Catalyst Poison
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Kovats Retention Index | 1703 |
|---|
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Flame Flammables GHS02 |
| GHS Hazard Statements |
H261:Substances And Mixtures Which, In Contact With Water,Emit Flammable Gases |
| Precautionary Statement Codes |
P403:Store in a well-ventilated place. |
COMPUTED DESCRIPTORS
| Molecular Weight | 182.3 g/mol |
|---|---|
| XLogP3 | 0 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 7 |
| Exact Mass | 182.04352203 g/mol |
| Monoisotopic Mass | 182.04352203 g/mol |
| Topological Polar Surface Area | 91.1 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 53.7 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |