ChemSpider 2D Image | Ethyl 2-(methylsulfonyl)-4-pyrimidinecarboxylate | C8H10N2O4S

Ethyl 2-(methylsulfonyl)-4-pyrimidinecarboxylate

  • Molecular FormulaC8H10N2O4S
  • Average mass230.241 Da
  • Monoisotopic mass230.036133 Da
  • ChemSpider ID24539832

More details:

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

250726-40-0 [RN]
2-Methanesulfonyl-pyrimidine-4-carboxylic acid ethyl ester
503072-46-6 [RN]
Ethyl 2-(methylsulfonyl)-4-pyrimidinecarboxylate
ethyl 2-(methylsulfonyl)pyrimidine-4-carboxylate
[503072-46-6] [RN]
2-(methylsulfonyl)-4-Pyrimidinecarboxylic acid ethyl ester
2-methanesulfonylpyrimidine-4-carboxylic acid ethyl ester
2-methylsulfonyl-4-pyrimidinecarboxylic acid ethyl ester
Ethyl 2-(methanesulfonyl)pyrimidine-4-carboxylate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 407.7±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.0±3.0 kJ/mol
Flash Point: 200.4±26.5 °C
Index of Refraction: 1.511
Molar Refractivity: 51.5±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.40
ACD/LogD (pH 5.5): 0.56
ACD/BCF (pH 5.5): 1.58
ACD/KOC (pH 5.5): 48.30
ACD/LogD (pH 7.4): 0.56
ACD/BCF (pH 7.4): 1.58
ACD/KOC (pH 7.4): 48.30
Polar Surface Area: 95 Å2
Polarizability: 20.4±0.5 10-24cm3
Surface Tension: 50.4±3.0 dyne/cm
Molar Volume: 172.1±3.0 cm3

Click to predict properties on the Chemicalize site


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