Found 1 result

Search term: VCMMQTXCEYFHNO (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 8-Pivaloyl-5,6,7,8-tetrahydro-1,8-naphthyridine-3-carbonitrile | C14H17N3O

8-Pivaloyl-5,6,7,8-tetrahydro-1,8-naphthyridine-3-carbonitrile

  • Molecular FormulaC14H17N3O
  • Average mass243.304 Da
  • Monoisotopic mass243.137161 Da
  • ChemSpider ID25996566

More details:






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

1,8-Naphthyridine-3-carbonitrile, 8-(2,2-dimethyl-1-oxopropyl)-5,6,7,8-tetrahydro- [ACD/Index Name]
1222533-78-9 [RN]
8-(2,2-dimethylpropanoyl)-5,6,7,8-tetrahydro[1,8]naphthyridine-3-carbonitrile
8-(2,2-Dimethylpropanoyl)-5,6,7,8-tetrahydro-1,8-naphthyridin-3-carbonitril [German] [ACD/IUPAC Name]
8-(2,2-Dimethylpropanoyl)-5,6,7,8-tetrahydro-1,8-naphthyridine-3-carbonitrile [ACD/IUPAC Name]
8-(2,2-Diméthylpropanoyl)-5,6,7,8-tétrahydro-1,8-naphtyridine-3-carbonitrile [French] [ACD/IUPAC Name]
8-Pivaloyl-5,6,7,8-tetrahydro-1,8-naphthyridine-3-carbonitrile
MFCD16628237 [MDL number]
[1222533-78-9]
8-(2,2-dimethylpropanoyl)-6,7-dihydro-5H-1,8-naphthyridine-3-carbonitrile
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 477.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.1±3.0 kJ/mol
Flash Point: 242.4±28.7 °C
Index of Refraction: 1.566
Molar Refractivity: 68.1±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.79
ACD/LogD (pH 5.5): 2.42
ACD/BCF (pH 5.5): 40.91
ACD/KOC (pH 5.5): 495.87
ACD/LogD (pH 7.4): 2.42
ACD/BCF (pH 7.4): 40.92
ACD/KOC (pH 7.4): 495.95
Polar Surface Area: 57 Å2
Polarizability: 27.0±0.5 10-24cm3
Surface Tension: 53.2±5.0 dyne/cm
Molar Volume: 208.7±5.0 cm3

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