2-Pyridin-3-yl-azepane Structure

2-Pyridin-3-yl-azepane

Chemical Properties

Boiling point 83-84 °C(Press: 16 Torr)
Density  1.0931 g/cm3(Temp: 15 °C)
refractive index  1.5475
storage temp.  under inert gas (nitrogen or Argon) at 2–8 °C
form  solid
pka 9.42±0.29(Predicted)
Appearance Light yellow to yellow Liquid
Sensitive  Air Sensitive
InChI 1S/C6H9NS/c1-5(7)6-3-2-4-8-6/h2-5H,7H2,1H3
InChIKey LYJBVRVJQXVVPI-UHFFFAOYSA-N
SMILES [s]1c(ccc1)C(N)C
CAS DataBase Reference 6309-16-6
FDA UNII LX6NX2S3AF
UNSPSC Code 12352116
NACRES NA.21

Safety

Symbol(GHS) Exclamation Mark (GHS07)Corrosion (GHS05)
Signal wordWarning
Hazard statements H302-H314-H318
Precautionary statements P260h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P405-P501a
Hazard Codes  C,Xi,Xn
Risk Statements  22
RIDADR  UN2735
WGK Germany  3
HazardClass  8
PackingGroup  III
HS Code  2934999090
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
NFPA 704:
0
3 0

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2-Pyridin-3-yl-azepane Spectrum