ChemSpider 2D Image | 3-(3-Nitropyrazolo[1,5-a]pyrimidin-6-yl)-2-propynoic acid | C9H4N4O4

3-(3-Nitropyrazolo[1,5-a]pyrimidin-6-yl)-2-propynoic acid

  • Molecular FormulaC9H4N4O4
  • Average mass232.152 Da
  • Monoisotopic mass232.023254 Da
  • ChemSpider ID89115459

More details:

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

2-Propynoic acid, 3-(3-nitropyrazolo[1,5-a]pyrimidin-6-yl)- [ACD/Index Name]
3-(3-Nitropyrazolo[1,5-a]pyrimidin-6-yl)-2-propinsäure [German] [ACD/IUPAC Name]
3-(3-Nitropyrazolo[1,5-a]pyrimidin-6-yl)-2-propynoic acid [ACD/IUPAC Name]
Acide 3-(3-nitropyrazolo[1,5-a]pyrimidin-6-yl)-2-propynoïque [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.733
Molar Refractivity: 56.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.09
ACD/LogD (pH 5.5): -3.75
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.77
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 113 Å2
Polarizability: 22.3±0.5 10-24cm3
Surface Tension: 81.5±7.0 dyne/cm
Molar Volume: 140.7±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement