ChemSpider 2D Image | ethyl 2-[2-(N'-acetylhydrazino)-2-oxo-ethyl]sulfanyl-4-amino-pyrimidine-5-carboxylate | C11H15N5O4S

ethyl 2-[2-(N'-acetylhydrazino)-2-oxo-ethyl]sulfanyl-4-amino-pyrimidine-5-carboxylate

  • Molecular FormulaC11H15N5O4S
  • Average mass313.333 Da
  • Monoisotopic mass313.084473 Da
  • ChemSpider ID22516791

More details:

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

ETHYL 2-{[(N`-ACETYLHYDRAZINECARBONYL)METHYL]SULFANYL}-4-AMINOPYRIMIDINE-5-CARBOXYLATE

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

Density: 1.4±0.1 g/cm3
Boiling Point: 612.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.9±3.0 kJ/mol
Flash Point: 323.9±28.7 °C
Index of Refraction: 1.604
Molar Refractivity: 75.8±0.4 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.90
ACD/LogD (pH 5.5): 0.86
ACD/BCF (pH 5.5): 2.65
ACD/KOC (pH 5.5): 69.87
ACD/LogD (pH 7.4): 0.86
ACD/BCF (pH 7.4): 2.63
ACD/KOC (pH 7.4): 69.51
Polar Surface Area: 162 Å2
Polarizability: 30.0±0.5 10-24cm3
Surface Tension: 74.2±5.0 dyne/cm
Molar Volume: 220.2±5.0 cm3

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