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Search term: 97118-49-5 (Found by synonym)

ChemSpider 2D Image | 4,4',4''-Trinitro-2,2':6',2''-terpyridine | C15H8N6O6

4,4',4''-Trinitro-2,2':6',2''-terpyridine

  • Molecular FormulaC15H8N6O6
  • Average mass368.261 Da
  • Monoisotopic mass368.050537 Da
  • ChemSpider ID35519015

More details:






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

2,2':6',2''-Terpyridine, 4,4',4''-trinitro- [ACD/Index Name]
4,4',4''-Trinitro-2,2':6',2''-terpyridin [German] [ACD/IUPAC Name]
4,4',4''-Trinitro-2,2':6',2''-terpyridine [ACD/IUPAC Name]
4,4',4''-Trinitro-2,2':6',2''-terpyridine [French] [ACD/IUPAC Name]
4,4',4''-Trinnitro-2,2':6',2''-terpyridine
97118-49-5 [RN]
MFCD18427276

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

Density: 1.6±0.1 g/cm3
Boiling Point: 598.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.8±3.0 kJ/mol
Flash Point: 315.5±30.1 °C
Index of Refraction: 1.685
Molar Refractivity: 89.3±0.3 cm3
#H bond acceptors: 12
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 0.13
ACD/LogD (pH 5.5): 1.68
ACD/BCF (pH 5.5): 11.19
ACD/KOC (pH 5.5): 196.02
ACD/LogD (pH 7.4): 1.68
ACD/BCF (pH 7.4): 11.19
ACD/KOC (pH 7.4): 196.02
Polar Surface Area: 176 Å2
Polarizability: 35.4±0.5 10-24cm3
Surface Tension: 79.8±3.0 dyne/cm
Molar Volume: 235.2±3.0 cm3

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