4-Bromo-3-phenyl-1H-pyrazol-5-amine Structure

4-Bromo-3-phenyl-1H-pyrazol-5-amine

Chemical Properties

Melting point 118-120 °C
Boiling point 438.5±45.0 °C(Predicted)
Density  1.6399 (rough estimate)
refractive index  1.6900 (estimate)
storage temp.  2-8°C
solubility  Methanol
form  Solid
pka 13.51±0.50(Predicted)
color  Off-White
InChI InChI=1S/C9H8BrN3/c10-7-8(12-13-9(7)11)6-4-2-1-3-5-6/h1-5H,(H3,11,12,13)
InChIKey QTNVXMOPTHGCII-UHFFFAOYSA-N
SMILES N1C(C2=CC=CC=C2)=C(Br)C(N)=N1
CAS DataBase Reference 2845-78-5(CAS DataBase Reference)

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Hazard Codes  Xi,Xn
Risk Statements  36/37/38-22
Safety Statements  37/39-26
Hazard Note  Irritant
HS Code  29331990
NFPA 704:
1
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