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Isopropyl isothiocyanate Structure

Isopropyl isothiocyanate

Chemical Properties

Melting point 168-170 °C
Boiling point 138 °C
Density  0.95
refractive index  1.49
FEMA  4425 | ISOPROPYL ISOTHIOCYANATE
Flash point 40 °C - closed cup
storage temp.  Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
form  clear liquid
Specific Gravity 0.95
color  Colorless to Light orange to Yellow
Odor at 0.01 % in propylene glycol. pungent mustard
Odor Type alliaceous
Water Solubility  Miscible with methanol. Hydrolyzes in water.
Sensitive  Moisture Sensitive
JECFA Number 1888
BRN  1739163
InChI 1S/C4H7NS/c1-4(2)5-3-6/h4H,1-2H3
InChIKey VHBFEIBMZHEWSX-UHFFFAOYSA-N
SMILES CC(C)N=C=S
LogP 1.82
CAS DataBase Reference 2253-73-8(CAS DataBase Reference)
NIST Chemistry Reference Isopropyl isothiocyanate(2253-73-8)

Safety Information

Hazard Codes  Xi,T
Risk Statements  10-36/37/38-23/24/25
Safety Statements  16-26-36-45-38-36/37/39-28A
RIDADR  UN 1993 3/PG 3
WGK Germany  3
HazardClass  8
PackingGroup  III
HS Code  29309090
Storage Class 3 - Flammable liquids
Hazard Classifications Eye Irrit. 2
Flam. Liq. 3
Skin Irrit. 2
STOT SE 3

MSDS

Usage And Synthesis

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