17452-27-6

Name 3-PYRIDYL ISOTHIOCYANATE
CAS 17452-27-6
Molecular Formula C6H4N2S
MDL Number MFCD00052351
Molecular Weight 136.17
MOL File 17452-27-6.mol
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Chemical Properties

Melting point  106.5-108 °C
Boiling point  231-233 °C(lit.)
density  1.22 g/mL at 25 °C(lit.)
refractive index  n20/D 1.665(lit.)
Fp  229 °F
storage temp.  0-10°C
form  clear liquid
pka 2.38±0.11(Predicted)
color  Colorless to Light orange to Yellow
λmax 282nm(Dioxane)(lit.)
InChI 1S/C6H4N2S/c9-5-8-6-2-1-3-7-4-6/h1-4H
InChIKey VMSZFBSYWXMXRF-UHFFFAOYSA-N
SMILES S=C=Nc1cccnc1

Safety Data

Symbol(GHS)  Corrosion (GHS05)Exclamation Mark (GHS07)
GHS05,GHS07
Signal word  Danger
Hazard statements  H302+H332-H315-H319-H335-H314
Precautionary statements  P280-P305+P351+P338-P310-P261-P264-P270-P271-P301+P312+P330-P302+P352+P332+P313+P362+P364-P304+P340+P312-P305+P351+P338+P337+P313-P403+P233-P405-P501
Hazard Codes  C,Xi
Risk Statements 
Safety Statements 
RIDADR  UN 3334
WGK Germany  3
Hazard Note  Irritant
HazardClass  IRRITANT
HS Code  29333990
Storage Class 8A - Combustible corrosive hazardous materials
Hazard Classifications Eye Dam. 1
Skin Corr. 1B

Hazard Information

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