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Search term: XMRJZVVWOPBOKP-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 5-(3-Chlorophenyl)-6-(3-phenoxypropyl)-2,4-pyrimidinediamine | C19H19ClN4O

5-(3-Chlorophenyl)-6-(3-phenoxypropyl)-2,4-pyrimidinediamine

  • Molecular FormulaC19H19ClN4O
  • Average mass354.833 Da
  • Monoisotopic mass354.124725 Da
  • ChemSpider ID127413159

More details:

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

2,4-Pyrimidinediamine, 5-(3-chlorophenyl)-6-(3-phenoxypropyl)- [ACD/Index Name]
5-(3-Chlorophenyl)-6-(3-phenoxypropyl)-2,4-pyrimidinediamine [ACD/IUPAC Name]
5-(3-Chlorophényl)-6-(3-phénoxypropyl)-2,4-pyrimidinediamine [French] [ACD/IUPAC Name]
5-(3-Chlorphenyl)-6-(3-phenoxypropyl)-2,4-pyrimidindiamin [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 621.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.1±3.0 kJ/mol
Flash Point: 329.8±34.3 °C
Index of Refraction: 1.653
Molar Refractivity: 100.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.23
ACD/LogD (pH 5.5): 2.80
ACD/BCF (pH 5.5): 35.50
ACD/KOC (pH 5.5): 174.43
ACD/LogD (pH 7.4): 4.10
ACD/BCF (pH 7.4): 717.94
ACD/KOC (pH 7.4): 3528.00
Polar Surface Area: 87 Å2
Polarizability: 40.0±0.5 10-24cm3
Surface Tension: 59.5±3.0 dyne/cm
Molar Volume: 275.4±3.0 cm3

Click to predict properties on the Chemicalize site


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