645-54-5

Name 2-PHENYLETHANETHIOAMIDE
CAS 645-54-5
Molecular Formula C8H9NS
MDL Number MFCD00022177
Molecular Weight 151.23
MOL File 645-54-5.mol
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Chemical Properties

Melting point  96-98°C
Boiling point  277.3±33.0℃ (760 Torr)
density  1.155±0.06 g/cm3 (20 ºC 760 Torr)
Fp  121.5±25.4℃
form  powder to crystal
pka 13.10±0.29(Predicted)
color  White to Orange to Green
Water Solubility  Slightly Soluble in water (1.8 g/L) (25°C).
InChI InChI=1S/C8H9NS/c9-8(10)6-7-4-2-1-3-5-7/h1-5H,6H2,(H2,9,10)
InChIKey CJXBHFANXQMZBF-UHFFFAOYSA-N
SMILES C1(CC(N)=S)=CC=CC=C1

Safety Data

Symbol(GHS)  Skull and Crossbones (GHS06)
GHS06
Signal word  Warning
Hazard statements  H301-H315-H319-H335
Precautionary statements  P261-P280a-P301+P310a-P305+P351+P338-P405-P501a
HazardClass  IRRITANT
HS Code  2924190090

Hazard Information

Spectrum Detail

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