ChemSpider 2D Image | N-[(2R)-1-Amino-2-propanyl]-4-chloro-1-methyl-1H-pyrazole-5-sulfonamide | C7H13ClN4O2S

N-[(2R)-1-Amino-2-propanyl]-4-chloro-1-methyl-1H-pyrazole-5-sulfonamide

  • Molecular FormulaC7H13ClN4O2S
  • Average mass252.722 Da
  • Monoisotopic mass252.044769 Da
  • ChemSpider ID55093107

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1H-Pyrazole-5-sulfonamide, N-[(1R)-2-amino-1-methylethyl]-4-chloro-1-methyl- [ACD/Index Name]
N-[(2R)-1-Amino-2-propanyl]-4-chlor-1-methyl-1H-pyrazol-5-sulfonamid [German] [ACD/IUPAC Name]
N-[(2R)-1-Amino-2-propanyl]-4-chloro-1-methyl-1H-pyrazole-5-sulfonamide [ACD/IUPAC Name]
N-[(2R)-1-Amino-2-propanyl]-4-chloro-1-méthyl-1H-pyrazole-5-sulfonamide [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: 424.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.9±3.0 kJ/mol
Flash Point: 210.4±31.5 °C
Index of Refraction: 1.639
Molar Refractivity: 58.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.80
ACD/LogD (pH 5.5): -2.77
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.27
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.39
Polar Surface Area: 98 Å2
Polarizability: 23.1±0.5 10-24cm3
Surface Tension: 57.7±7.0 dyne/cm
Molar Volume: 161.7±7.0 cm3

Click to predict properties on the Chemicalize site


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