ChemSpider 2D Image | 2-Amino-6-(benzylsulfanyl)-4-pyrimidinecarboxylate | C12H10N3O2S

2-Amino-6-(benzylsulfanyl)-4-pyrimidinecarboxylate

  • Molecular FormulaC12H10N3O2S
  • Average mass260.292 Da
  • Monoisotopic mass260.049927 Da
  • ChemSpider ID21203466

  • Charge - Charge

More details:

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

2-Amino-6-(benzylsulfanyl)-4-pyrimidincarboxylat [German] [ACD/IUPAC Name]
2-Amino-6-(benzylsulfanyl)-4-pyrimidinecarboxylate [ACD/IUPAC Name]
2-Amino-6-(benzylsulfanyl)-4-pyrimidinecarboxylate [French] [ACD/IUPAC Name]
4-Pyrimidinecarboxylic acid, 2-amino-6-[(phenylmethyl)thio]-, ion(1-) [ACD/Index Name]

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

Density:
Boiling Point: 560.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.7±3.0 kJ/mol
Flash Point: 292.8±32.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.11
ACD/LogD (pH 5.5): 0.70
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.01
ACD/LogD (pH 7.4): -0.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 117 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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