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3-(Diethylamino)propyl isothiocyanate Structure

3-(Diethylamino)propyl isothiocyanate

Chemical Properties

Boiling point 95 °C
Density  0.954 g/mL at 25 °C (lit.)
refractive index  n20/D 1.5000(lit.)
Flash point >230 °F
storage temp.  2-8°C
pka 10.14±0.25(Predicted)
Specific Gravity 0.95
Sensitive  Moisture Sensitive
BRN  1757446
InChI InChI=1S/C8H16N2S/c1-3-10(4-2)7-5-6-9-8-11/h3-7H2,1-2H3
InChIKey QPBVKSLJBRCKIF-UHFFFAOYSA-N
SMILES C(N(CC)CC)CCN=C=S
CAS DataBase Reference 2626-52-0(CAS DataBase Reference)

Safety Information

Hazard Codes  Xn
Risk Statements  22-37/38-41
Safety Statements  26-39
RIDADR  2927
WGK Germany  3
HazardClass  6.1
PackingGroup  II
HS Code  29309090
Storage Class 10 - Combustible liquids
Hazard Classifications Acute Tox. 4 Oral
Eye Dam. 1
Skin Irrit. 2
STOT SE 3

MSDS

Usage And Synthesis

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