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Dodecyl methyl sulfide Structure

Dodecyl methyl sulfide

Chemical Properties

Melting point -2°C(lit.)
Boiling point 110 °C/0.2 mmHg (lit.)
Density  0.816 g/mL at 25 °C (lit.)
refractive index  n20/D 1.4610(lit.)
Flash point >230 °F
storage temp.  2-8°C, stored under nitrogen
form  Liquid
color  Colorless to Almost colorless
Henry's Law Constant 1.8×10-3 mol/(m3Pa) at 25℃, Yaws et al. (2003)
InChI 1S/C13H28S/c1-3-4-5-6-7-8-9-10-11-12-13-14-2/h3-13H2,1-2H3
InChIKey KJWHJDGMOQJLGF-UHFFFAOYSA-N
SMILES CCCCCCCCCCCCSC
LogP 6.582 (est)
CAS DataBase Reference 3698-89-3(CAS DataBase Reference)
NIST Chemistry Reference N-dodecylmethyl sulfide(3698-89-3)
EPA Substance Registry System Dodecane, 1-(methylthio)- (3698-89-3)

Safety Information

RIDADR  UN 3334
WGK Germany  3
TSCA  TSCA listed
HS Code  29309090
Storage Class 10 - Combustible liquids
Hazard Classifications Aquatic Chronic 4

MSDS

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