ChemSpider 2D Image | 4-[(6-Anilino[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl)amino]phenol | C16H12N6O2

4-[(6-Anilino[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl)amino]phenol

  • Molecular FormulaC16H12N6O2
  • Average mass320.306 Da
  • Monoisotopic mass320.102173 Da
  • ChemSpider ID17752828

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

4-(6-Phenylamino-[1,2,5]oxadiazolo[3,4-b]pyrazin-5-ylamino)-phenol
4-[(6-Anilino[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl)amino]phenol [ACD/IUPAC Name]
4-[(6-Anilino[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl)amino]phenol [German] [ACD/IUPAC Name]
4-[(6-Anilino[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl)amino]phénol [French] [ACD/IUPAC Name]
Phenol, 4-[[6-(phenylamino)[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl]amino]- [ACD/Index Name]
4-{[6-(phenylamino)[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl]amino}phenol
4-{[6-(phenylamino)-1,2,5-oxadiazolo[3,4-e]pyrazin-5-yl]amino}phenol

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 496.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.3±3.0 kJ/mol
Flash Point: 254.0±31.5 °C
Index of Refraction: 1.797
Molar Refractivity: 89.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.59
ACD/LogD (pH 5.5): 2.99
ACD/BCF (pH 5.5): 109.88
ACD/KOC (pH 5.5): 1005.71
ACD/LogD (pH 7.4): 2.98
ACD/BCF (pH 7.4): 108.11
ACD/KOC (pH 7.4): 989.51
Polar Surface Area: 109 Å2
Polarizability: 35.4±0.5 10-24cm3
Surface Tension: 88.5±3.0 dyne/cm
Molar Volume: 209.8±3.0 cm3

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