Found 67 results

Search term: MF = 'C_{3}H_{8}N_{4}O_{2}'
ChemSpider 2D Image | 1-Nitro-1,3,5-triazinane | C3H8N4O2

1-Nitro-1,3,5-triazinane

  • Molecular FormulaC3H8N4O2
  • Average mass132.121 Da
  • Monoisotopic mass132.064728 Da
  • ChemSpider ID28584637

More details:

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

1,3,5-Triazine, hexahydro-1-nitro- [ACD/Index Name]
1-Nitro-1,3,5-triazinan [German] [ACD/IUPAC Name]
1-Nitro-1,3,5-triazinane [ACD/IUPAC Name]
1-Nitro-1,3,5-triazinane [French] [ACD/IUPAC Name]
190895-02-4 [RN]
1-Nitro-3,5-dihydro-1,3,5-triazine

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

Density: 1.4±0.1 g/cm3
Boiling Point: 353.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.9±3.0 kJ/mol
Flash Point: 167.7±27.9 °C
Index of Refraction: 1.573
Molar Refractivity: 31.1±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.43
ACD/LogD (pH 5.5): -2.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.26
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.76
Polar Surface Area: 73 Å2
Polarizability: 12.3±0.5 10-24cm3
Surface Tension: 59.4±5.0 dyne/cm
Molar Volume: 94.5±5.0 cm3

Click to predict properties on the Chemicalize site


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