Found 34 results

Search term: MF = 'C_{8}H_{6}BrN_{5}OS'
ChemSpider 2D Image | 2-[(2-Amino-5-bromo-4-pyrimidinyl)sulfanyl]-4-pyrimidinol | C8H6BrN5OS

2-[(2-Amino-5-bromo-4-pyrimidinyl)sulfanyl]-4-pyrimidinol

  • Molecular FormulaC8H6BrN5OS
  • Average mass300.135 Da
  • Monoisotopic mass298.947632 Da
  • ChemSpider ID36495270

More details:

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

2-[(2-Amino-5-brom-4-pyrimidinyl)sulfanyl]-4-pyrimidinol [German] [ACD/IUPAC Name]
2-[(2-Amino-5-bromo-4-pyrimidinyl)sulfanyl]-4-pyrimidinol [ACD/IUPAC Name]
2-[(2-Amino-5-bromo-4-pyrimidinyl)sulfanyl]-4-pyrimidinol [French] [ACD/IUPAC Name]
4-Pyrimidinol, 2-[(2-amino-5-bromo-4-pyrimidinyl)thio]- [ACD/Index Name]

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

Density: 2.0±0.1 g/cm3
Boiling Point: 635.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 97.4±3.0 kJ/mol
Flash Point: 338.3±34.3 °C
Index of Refraction: 1.794
Molar Refractivity: 63.5±0.4 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.33
ACD/LogD (pH 5.5): 0.78
ACD/BCF (pH 5.5): 2.23
ACD/KOC (pH 5.5): 59.79
ACD/LogD (pH 7.4): -0.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.45
Polar Surface Area: 123 Å2
Polarizability: 25.2±0.5 10-24cm3
Surface Tension: 131.8±5.0 dyne/cm
Molar Volume: 149.4±5.0 cm3

Click to predict properties on the Chemicalize site


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