ChemSpider 2D Image | Ethyl 4-amino-2-(3-pyridinyl)-5-pyrimidinecarboxylate | C12H12N4O2

Ethyl 4-amino-2-(3-pyridinyl)-5-pyrimidinecarboxylate

  • Molecular FormulaC12H12N4O2
  • Average mass244.249 Da
  • Monoisotopic mass244.096024 Da
  • ChemSpider ID21402888

More details:

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

1053656-10-2 [RN]
4-Amino-2-(3-pyridinyl)-5-pyrimidinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
5-Pyrimidinecarboxylic acid, 4-amino-2-(3-pyridinyl)-, ethyl ester [ACD/Index Name]
Ethyl 4-amino-2-(3-pyridinyl)-5-pyrimidinecarboxylate [ACD/IUPAC Name]
Ethyl 4-amino-2-(pyridin-3-yl)pyrimidine-5-carboxylate
Ethyl-4-amino-2-(3-pyridinyl)-5-pyrimidincarboxylat [German] [ACD/IUPAC Name]
4-amino-2-(3-pyridinyl)-5-pyrimidinecarboxylic acid ethyl ester
4-Amino-2-(3-pyridinyl)-5-pyrimidinecarboxylic acidethylester
4-Amino-2-pyridin-3-yl-pyrimidine-5-carboxylic acid ethyl ester
MFCD10699242 [MDL number]

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


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

Density: 1.3±0.1 g/cm3
Boiling Point: 354.8±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.0±3.0 kJ/mol
Flash Point: 168.4±25.7 °C
Index of Refraction: 1.604
Molar Refractivity: 65.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.59
ACD/LogD (pH 5.5): 1.38
ACD/BCF (pH 5.5): 6.63
ACD/KOC (pH 5.5): 134.78
ACD/LogD (pH 7.4): 1.38
ACD/BCF (pH 7.4): 6.63
ACD/KOC (pH 7.4): 134.85
Polar Surface Area: 91 Å2
Polarizability: 26.1±0.5 10-24cm3
Surface Tension: 60.8±3.0 dyne/cm
Molar Volume: 191.1±3.0 cm3

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