ChemSpider 2D Image | 6-Chloro-N~4~-[3-(dimethylamino)propyl]-4,5-pyrimidinediamine | C9H16ClN5

6-Chloro-N4-[3-(dimethylamino)propyl]-4,5-pyrimidinediamine

  • Molecular FormulaC9H16ClN5
  • Average mass229.710 Da
  • Monoisotopic mass229.109421 Da
  • ChemSpider ID40130272

More details:






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

4,5-Pyrimidinediamine, 6-chloro-N4-[3-(dimethylamino)propyl]- [ACD/Index Name]
6-Chlor-N4-[3-(dimethylamino)propyl]-4,5-pyrimidindiamin [German] [ACD/IUPAC Name]
6-Chloro-N4-[3-(dimethylamino)propyl]-4,5-pyrimidinediamine [ACD/IUPAC Name]
6-Chloro-N4-[3-(diméthylamino)propyl]-4,5-pyrimidinediamine [French] [ACD/IUPAC Name]
88455-90-7 [RN]
MFCD17277449

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 389.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.9±3.0 kJ/mol
Flash Point: 189.6±27.9 °C
Index of Refraction: 1.610
Molar Refractivity: 63.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.53
ACD/LogD (pH 5.5): -1.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.50
Polar Surface Area: 67 Å2
Polarizability: 25.1±0.5 10-24cm3
Surface Tension: 56.4±3.0 dyne/cm
Molar Volume: 182.8±3.0 cm3

Click to predict properties on the Chemicalize site






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