ChemSpider 2D Image | 4-Chloro-2-(4,6-diamino-1,3,5-triazin-2-yl)phenol | C9H8ClN5O

4-Chloro-2-(4,6-diamino-1,3,5-triazin-2-yl)phenol

  • Molecular FormulaC9H8ClN5O
  • Average mass237.646 Da
  • Monoisotopic mass237.041733 Da
  • ChemSpider ID21474782

More details:

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

4-Chlor-2-(4,6-diamino-1,3,5-triazin-2-yl)phenol [German] [ACD/IUPAC Name]
4-Chloro-2-(4,6-diamino-1,3,5-triazin-2-yl)phenol [ACD/IUPAC Name]
4-Chloro-2-(4,6-diamino-1,3,5-triazin-2-yl)phénol [French] [ACD/IUPAC Name]
Phenol, 4-chloro-2-(4,6-diamino-1,3,5-triazin-2-yl)- [ACD/Index Name]
X06

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

Density: 1.6±0.1 g/cm3
Boiling Point: 583.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.5±3.0 kJ/mol
Flash Point: 306.8±32.9 °C
Index of Refraction: 1.742
Molar Refractivity: 60.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 2.94
ACD/LogD (pH 5.5): 1.96
ACD/BCF (pH 5.5): 17.75
ACD/KOC (pH 5.5): 266.65
ACD/LogD (pH 7.4): 1.29
ACD/BCF (pH 7.4): 3.86
ACD/KOC (pH 7.4): 57.94
Polar Surface Area: 111 Å2
Polarizability: 23.9±0.5 10-24cm3
Surface Tension: 94.5±3.0 dyne/cm
Molar Volume: 149.3±3.0 cm3

Click to predict properties on the Chemicalize site


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