4,4'-Dimethylthiocarbanilide Structure

4,4'-Dimethylthiocarbanilide

Chemical Properties

Melting point 182-184 °C (lit.)
Boiling point 377.7±45.0 °C(Predicted)
Density  1.219±0.06 g/cm3(Predicted)
storage temp.  Store at room temperature
pka 12.34±0.70(Predicted)
form  powder to crystal
color  White to Orange to Green
InChI 1S/C15H16N2S/c1-11-3-7-13(8-4-11)16-15(18)17-14-9-5-12(2)6-10-14/h3-10H,1-2H3,(H2,16,17,18)
InChIKey ULNVBRUIKLYGDF-UHFFFAOYSA-N
SMILES Cc1ccc(NC(=S)Nc2ccc(C)cc2)cc1
CAS DataBase Reference 621-01-2(CAS DataBase Reference)
FDA UNII GPP4Q8300Z
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) Skull and Crossbones (GHS06)
Signal wordDanger
Hazard statements H301
Precautionary statements P501-P270-P264-P301+P310+P330-P405
WGK Germany  3
RTECS  FE0875000
HS Code  2930.90.2900
HazardClass  IRRITANT
Storage Class 11 - Combustible Solids

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