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2-Amino-1-methyl-6-phenylimidazo[4,5-b]pyridine Structure

2-Amino-1-methyl-6-phenylimidazo[4,5-b]pyridine

Chemical Properties

Melting point 300
Boiling point 355.66°C (rough estimate)
Density  1.2067 (rough estimate)
refractive index  1.5890 (estimate)
storage temp.  Refrigerator
solubility  DMF: 10 mg/ml; DMSO: 10 mg/ml; Ethanol: 15 mg/ml; Ethanol:PBS (pH 7.2) (1:3): 0.25 mg/ml
form  A crystalline solid
pka 7.72±0.30(Predicted)
color  White to light yellow
biological source synthetic
Henry's Law Constant 3.5×107 mol/(m3Pa) at 25℃, HSDB (2015)
InChI 1S/C13H12N4/c1-17-11-7-10(9-5-3-2-4-6-9)8-15-12(11)16-13(17)14/h2-8H,1H3,(H2,14,15,16)
InChIKey UQVKZNNCIHJZLS-UHFFFAOYSA-N
SMILES NC1=NC2=NC=C(C3=CC=CC=C3)C=C2N1C
CAS DataBase Reference 105650-23-5(CAS DataBase Reference)
IARC 2B (Vol. 56) 1993

Safety Information

Hazard Codes  T
WGK Germany  WGK 3
Hazard Note  Toxic
HS Code  29333999
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Oral
Carc. 2
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazardous Substances Data 105650-23-5(Hazardous Substances Data)

Usage And Synthesis

Preparation Products And Raw materials

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