271-29-4

Name 6-Azaindole
CAS 271-29-4
EINECS(EC#) 664-233-5
Molecular Formula C7H6N2
MDL Number MFCD06738911
Molecular Weight 118.14
MOL File 271-29-4.mol

Chemical Properties

Melting point  136-137°C
Boiling point  295.8±13.0 °C(Predicted)
density  1.242±0.06 g/cm3(Predicted)
RTECS  UY8720000
storage temp.  Keep in dark place,Inert atmosphere,2-8°C
form  Solid
pka 14.66±0.30(Predicted)
Appearance Off-white to light brown Solid
Water Solubility  Soluble in water (hardly), methanol and chloroform.
Sensitive  Air & Light Sensitive
InChI InChI=1S/C7H6N2/c1-3-8-5-7-6(1)2-4-9-7/h1-5,9H
InChIKey XLKDJOPOOHHZAN-UHFFFAOYSA-N
SMILES C1=NC=CC2C=CNC1=2
CAS DataBase Reference 271-29-4(CAS DataBase Reference)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Hazard Codes  Xi
WGK Germany  WGK 3
Hazard Note  Irritant
HS Code  29339980
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Eye Dam. 1
Skin Irrit. 2
STOT SE 3
Toxicity
mouse,LD50,intraperitoneal,12mg/kg (12mg/kg),Journal of Medicinal Chemistry. Vol. 6, Pg. 480, 1963.

Hazard Information

Spectrum Detail

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