Molecular Structure of 5-Bromo-[1,7]naphthyridin-8-ylamine (CAS NO.67967-17-3):
Systematic Name: 5-Bromo-1,7-naphthyridin-8-amine
SMILES: Brc1cnc(N)c2ncccc12
InChI: InChI=1/C8H6BrN3/c9-6-4-12-8(10)7-5(6)2-1-3-11-7/h1-4H,(H2,10,12)
InChIKey: NGCIOHWBZLIGLV-UHFFFAOYAI
Molecular Formula: C8H6BrN3
Molecular Weight: 224.06
Nominal Mass: 223
Average Mass: 224.0573
Monoisotopic Mass: 222.974502
H bond acceptors: 3
H bond donors: 2
Freely Rotating Bonds: 0
Index of Refraction: 1.747
Molar Refractivity: 52.204 cm3
Molar Volume: 128.462 cm3
Surface Tension: 73.184 dyne/cm
Density: 1.744 g/cm3
Flash Point: 171.586 °C
Enthalpy of Vaporization: 60.578 kJ/mol
Boiling Point: 360.106 °C at 760 mmHg
Vapour Pressure: 0 mmHg at 25 °C
5-Bromo-[1,7]naphthyridin-8-ylamine (CAS NO.67967-17-3), its Synonyms are 8-Amino-5-bromo-1,7-naphthyridine ; 1,7-Naphthyridin-8-amine, 5-bromo- .
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