ChemSpider 2D Image | Ethyl (2Z)-3-[2-amino-4,6-bis(dimethylamino)-5-pyrimidinyl]-2-cyanoacrylate | C14H20N6O2

Ethyl (2Z)-3-[2-amino-4,6-bis(dimethylamino)-5-pyrimidinyl]-2-cyanoacrylate

  • Molecular FormulaC14H20N6O2
  • Average mass304.348 Da
  • Monoisotopic mass304.164764 Da
  • ChemSpider ID30654095

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-3-[2-Amino-4,6-bis(diméthylamino)-5-pyrimidinyl]-2-cyanoacrylate d'éthyle [French] [ACD/IUPAC Name]
2-Propenoic acid, 3-[2-amino-4,6-bis(dimethylamino)-5-pyrimidinyl]-2-cyano-, ethyl ester, (2Z)- [ACD/Index Name]
Ethyl (2Z)-3-[2-amino-4,6-bis(dimethylamino)-5-pyrimidinyl]-2-cyanoacrylate [ACD/IUPAC Name]
Ethyl-(2Z)-3-[2-amino-4,6-bis(dimethylamino)-5-pyrimidinyl]-2-cyanacrylat [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: 556.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.8±3.0 kJ/mol
Flash Point: 290.3±32.9 °C
Index of Refraction: 1.637
Molar Refractivity: 86.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.85
ACD/LogD (pH 5.5): 1.82
ACD/BCF (pH 5.5): 11.99
ACD/KOC (pH 5.5): 169.31
ACD/LogD (pH 7.4): 2.11
ACD/BCF (pH 7.4): 23.59
ACD/KOC (pH 7.4): 333.14
Polar Surface Area: 108 Å2
Polarizability: 34.3±0.5 10-24cm3
Surface Tension: 61.9±3.0 dyne/cm
Molar Volume: 241.3±3.0 cm3

Click to predict properties on the Chemicalize site


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