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1-ADAMANTYL ISOTHIOCYANATE Structure

1-ADAMANTYL ISOTHIOCYANATE

Chemical Properties

Melting point 166-168 °C (lit.)
Density  1.35
refractive index  1.5500 (estimate)
form  powder to crystal
color  White to Orange to Green
InChI InChI=1S/C11H15NS/c13-7-12-11-4-8-1-9(5-11)3-10(2-8)6-11/h8-10H,1-6H2
InChIKey YPKFLUARLJRPQM-UHFFFAOYSA-N
SMILES C12(N=C=S)CC3CC(CC(C3)C1)C2
CAS DataBase Reference 4411-26-1(CAS DataBase Reference)

Safety Information

Hazard Codes  Xn
Risk Statements  20/21/22-36/37/38
Safety Statements  26-37/39
RIDADR  2811
WGK Germany  3
HS Code  2930.90.9250
HazardClass  6.1(b)
PackingGroup  III
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

MSDS

Usage And Synthesis

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