Molecule structure of 4-Phenylazopyridine (CAS NO.2569-58-6):
IUPAC Name: Phenyl(pyridin-4-yl)diazene
Molecular Weight: 183.20926 g/mol
Molecular Formula: C11H9N3
Density: 1.09 g/cm3
Boiling Point: 317.6 °C at 760 mmHg
Flash Point: 145.9 °C
Index of Refraction: 1.603
Molar Refractivity: 57.3 cm3
Molar Volume: 166.7 cm3
Polarizability: 22.71×10-24 cm3
Surface Tension: 43.7 dyne/cm
Enthalpy of Vaporization: 53.68 kJ/mol
Vapour Pressure: 0.000709 mmHg at 25 °C
XLogP3-AA: 2.6
H-Bond Acceptor: 3
Rotatable Bond Count: 2
Exact Mass: 183.079647
MonoIsotopic Mass: 183.079647
Topological Polar Surface Area: 37.6
Heavy Atom Count: 14
Complexity: 179
Canonical SMILES: C1=CC=C(C=C1)N=NC2=CC=NC=C2
InChI: InChI=1S/C11H9N3/c1-2-4-10(5-3-1)13-14-11-6-8-12-9-7-11/h1-9H
InChIKey of 4-Phenylazopyridine (CAS NO.2569-58-6): STGZUKHALNSQAG-UHFFFAOYSA-N
1. | orl-mus LDLo:80 mg/kg | NYKZAU Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. 63 (1967),95. |
A poison by ingestion. When heated to decomposition it emits toxic vapors of NOx.
4-Phenylazopyridine (CAS NO.2569-58-6) is also named as NSC 170640 ; Pyridine, 4-(phenylazo)- .
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