1,8-Octanedithiol Structure

1,8-Octanedithiol

Chemical Properties

Melting point 1°C(lit.)
Boiling point 269-270 °C (lit.)
Density  0.97 g/mL at 25 °C (lit.)
FLAVIS Number 12.034 | Octane-1,8-dithiol
FEMA  3514 | 1,8-OCTANEDITHIOL
refractive index  n20/D 1.505(lit.)
Flash point >230 °F
storage temp.  Store at room temperature, keep dry and cool
pka 10.19±0.10(Predicted)
form  Liquid
color  Colorless to pale yellow
Odor at 0.10 % in propylene glycol. sulfurous meaty mushroom earthy
Odor Type sulfurous
biological source synthetic
Sensitive  Air Sensitive
JECFA Number 541
BRN  1735431
Stability Stable. Combustible. Incompatible with strong oxidizing agents, strong bases.
InChI 1S/C8H18S2/c9-7-5-3-1-2-4-6-8-10/h9-10H,1-8H2
InChIKey PGTWZHXOSWQKCY-UHFFFAOYSA-N
SMILES SCCCCCCCCS
LogP 4.21
CAS DataBase Reference 1191-62-4(CAS DataBase Reference)
Substances Added to Food (formerly EAFUS) 1,8-OCTANEDITHIOL
EWG's Food Scores 1
FDA UNII KH3W3161HS
UNSPSC Code 12352103
NACRES NA.23

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H315-H319-H302
Precautionary statements P301+P312a-P330-P501a-P264-P270-P280-P301+P312+P330-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P501
Hazard Codes  Xn
Risk Statements  22-36/37/38-20/21/22
Safety Statements  36-36/37/39-26
RIDADR  UN 1170
WGK Germany  3
RTECS  RG9610000
HS Code  29309090
Storage Class 10 - Combustible liquids
Hazard Classifications Acute Tox. 4 Oral
NFPA 704:
1
2 0

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1,8-Octanedithiol Spectrum