ChemSpider 2D Image | N-[1-(3-Amino-3-oxopropyl)-1H-pyrazol-3-yl]-4-iodobenzamide | C13H13IN4O2

N-[1-(3-Amino-3-oxopropyl)-1H-pyrazol-3-yl]-4-iodobenzamide

  • Molecular FormulaC13H13IN4O2
  • Average mass384.172 Da
  • Monoisotopic mass384.008301 Da
  • ChemSpider ID32013182

More details:

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

1H-Pyrazole-1-propanamide, 3-[(4-iodobenzoyl)amino]- [ACD/Index Name]
N-[1-(3-Amino-3-oxopropyl)-1H-pyrazol-3-yl]-4-iodbenzamid [German] [ACD/IUPAC Name]
N-[1-(3-Amino-3-oxopropyl)-1H-pyrazol-3-yl]-4-iodobenzamide [ACD/IUPAC Name]
N-[1-(3-Amino-3-oxopropyl)-1H-pyrazol-3-yl]-4-iodobenzamide [French] [ACD/IUPAC Name]
N-[1-(2-CARBAMOYLETHYL)-1H-PYRAZOL-3-YL]-4-IODOBENZAMIDE
N-[1-(2-CARBAMOYLETHYL)PYRAZOL-3-YL]-4-IODOBENZAMIDE

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

Density: 1.8±0.1 g/cm3
Boiling Point: 506.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.6±3.0 kJ/mol
Flash Point: 259.8±27.3 °C
Index of Refraction: 1.710
Molar Refractivity: 83.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.30
ACD/LogD (pH 5.5): 1.63
ACD/BCF (pH 5.5): 10.16
ACD/KOC (pH 5.5): 183.02
ACD/LogD (pH 7.4): 1.63
ACD/BCF (pH 7.4): 10.16
ACD/KOC (pH 7.4): 183.02
Polar Surface Area: 90 Å2
Polarizability: 33.2±0.5 10-24cm3
Surface Tension: 62.3±7.0 dyne/cm
Molar Volume: 214.1±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement