65676-21-3

Name alpha-(4-chlorophenyl)-alpha-[2-(dimethylamino)ethyl]pyridine-2-acetonitrile
CAS 65676-21-3
EINECS(EC#) 265-869-2
Molecular Formula C17H18ClN3
MDL Number MFCD21363477
Molecular Weight 299.8
MOL File 65676-21-3.mol
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Chemical Properties

Boiling point  154-164 °C(Press: 0.2 Torr)
density  1.161±0.06 g/cm3(Predicted)
storage temp.  2-8°C
pka 8.60±0.28(Predicted)
Major Application pharmaceutical small molecule
InChI InChI=1S/C17H18ClN3/c1-21(2)12-10-17(13-19,16-5-3-4-11-20-16)14-6-8-15(18)9-7-14/h3-9,11H,10,12H2,1-2H3
InChIKey XWFSLFHFPQWKNV-UHFFFAOYSA-N
SMILES C1(C(C2=CC=C(Cl)C=C2)(CCN(C)C)C#N)=NC=CC=C1

Safety Data

Symbol(GHS)  Skull and Crossbones (GHS06)
GHS06
Signal word  Danger
Hazard statements  H301
Precautionary statements  P264-P270-P301+P310+P330-P405-P501
WGK Germany  WGK 3
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Oral

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