ChemSpider 2D Image | (6-Methyl-5-oxo-2,5-dihydro-1,2,4-triazin-3-yl)malononitrile | C7H5N5O

(6-Methyl-5-oxo-2,5-dihydro-1,2,4-triazin-3-yl)malononitrile

  • Molecular FormulaC7H5N5O
  • Average mass175.148 Da
  • Monoisotopic mass175.049408 Da
  • ChemSpider ID21678008

More details:

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

(6-Methyl-5-oxo-2,5-dihydro-1,2,4-triazin-3-yl)malononitril [German] [ACD/IUPAC Name]
(6-Methyl-5-oxo-2,5-dihydro-1,2,4-triazin-3-yl)malononitrile [ACD/IUPAC Name]
(6-Méthyl-5-oxo-2,5-dihydro-1,2,4-triazin-3-yl)malononitrile [French] [ACD/IUPAC Name]
Propanedinitrile, 2-(4,5-dihydro-6-methyl-5-oxo-1,2,4-triazin-3-yl)- [ACD/Index Name]
2-(5-Hydroxy-6-methyl-[1,2,4]triazin-3-yl)-malononitrile
893707-83-0 [RN]
MFCD11108060

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.685
Molar Refractivity: 45.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -1.47
ACD/LogD (pH 5.5): -0.73
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.57
ACD/LogD (pH 7.4): -2.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 101 Å2
Polarizability: 18.2±0.5 10-24cm3
Surface Tension: 63.8±7.0 dyne/cm
Molar Volume: 120.8±7.0 cm3

Click to predict properties on the Chemicalize site


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