Found 894 results

Search term: MF = 'C_{11}H_{9}F_{2}N_{3}O_{2}'
ChemSpider 2D Image | 3-Amino-1-(2,3-difluorobenzyl)-1H-pyrazole-4-carboxylic acid | C11H9F2N3O2

3-Amino-1-(2,3-difluorobenzyl)-1H-pyrazole-4-carboxylic acid

  • Molecular FormulaC11H9F2N3O2
  • Average mass253.205 Da
  • Monoisotopic mass253.066284 Da
  • ChemSpider ID53608029

More details:

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

1H-Pyrazole-4-carboxylic acid, 3-amino-1-[(2,3-difluorophenyl)methyl]- [ACD/Index Name]
3-Amino-1-(2,3-difluorbenzyl)-1H-pyrazol-4-carbonsäure [German] [ACD/IUPAC Name]
3-Amino-1-(2,3-difluorobenzyl)-1H-pyrazole-4-carboxylic acid [ACD/IUPAC Name]
Acide 3-amino-1-(2,3-difluorobenzyl)-1H-pyrazole-4-carboxylique [French] [ACD/IUPAC Name]
1856047-43-2 [RN]
MFCD29911870

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

Density: 1.5±0.1 g/cm3
Boiling Point: 470.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.2±3.0 kJ/mol
Flash Point: 238.3±28.7 °C
Index of Refraction: 1.626
Molar Refractivity: 58.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.88
ACD/LogD (pH 5.5): 1.18
ACD/BCF (pH 5.5): 2.61
ACD/KOC (pH 5.5): 34.99
ACD/LogD (pH 7.4): -0.49
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 81 Å2
Polarizability: 23.2±0.5 10-24cm3
Surface Tension: 51.1±7.0 dyne/cm
Molar Volume: 165.4±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement