ChemSpider 2D Image | 7-Hydroxy[1,2]thiazolo[4,5-d]pyrimidine-3-carbonitrile | C6H2N4OS

7-Hydroxy[1,2]thiazolo[4,5-d]pyrimidine-3-carbonitrile

  • Molecular FormulaC6H2N4OS
  • Average mass178.171 Da
  • Monoisotopic mass177.994934 Da
  • ChemSpider ID62089013

More details:

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

7-Hydroxy[1,2]thiazolo[4,5-d]pyrimidin-3-carbonitril [German] [ACD/IUPAC Name]
7-Hydroxy[1,2]thiazolo[4,5-d]pyrimidine-3-carbonitrile [ACD/IUPAC Name]
7-Hydroxy[1,2]thiazolo[4,5-d]pyrimidine-3-carbonitrile [French] [ACD/IUPAC Name]
Isothiazolo[4,5-d]pyrimidine-3-carbonitrile, 7-hydroxy- [ACD/Index Name]
2092272-87-0 [RN]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 319.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.4±3.0 kJ/mol
Flash Point: 147.3±27.9 °C
Index of Refraction: 1.778
Molar Refractivity: 41.9±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.19
ACD/LogD (pH 5.5): -2.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.94
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 111 Å2
Polarizability: 16.6±0.5 10-24cm3
Surface Tension: 140.1±5.0 dyne/cm
Molar Volume: 100.2±5.0 cm3

Click to predict properties on the Chemicalize site


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