ChemSpider 2D Image | 3-(Butoxymethyl)-1-cyclopentyl-1H-pyrazole-4-sulfonyl chloride | C13H21ClN2O3S

3-(Butoxymethyl)-1-cyclopentyl-1H-pyrazole-4-sulfonyl chloride

  • Molecular FormulaC13H21ClN2O3S
  • Average mass320.835 Da
  • Monoisotopic mass320.096130 Da
  • ChemSpider ID53606546

More details:

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

1H-Pyrazole-4-sulfonyl chloride, 3-(butoxymethyl)-1-cyclopentyl- [ACD/Index Name]
3-(Butoxymethyl)-1-cyclopentyl-1H-pyrazol-4-sulfonylchlorid [German] [ACD/IUPAC Name]
3-(Butoxymethyl)-1-cyclopentyl-1H-pyrazole-4-sulfonyl chloride [ACD/IUPAC Name]
Chlorure de 3-(butoxyméthyl)-1-cyclopentyl-1H-pyrazole-4-sulfonyle [French] [ACD/IUPAC Name]
1856076-21-5 [RN]
3-(BUTOXYMETHYL)-1-CYCLOPENTYLPYRAZOLE-4-SULFONYL CHLORIDE
MFCD29910482

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

Density: 1.4±0.1 g/cm3
Boiling Point: 443.3±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.4±3.0 kJ/mol
Flash Point: 221.9±25.9 °C
Index of Refraction: 1.594
Molar Refractivity: 79.9±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.16
ACD/LogD (pH 5.5): 3.03
ACD/BCF (pH 5.5): 117.25
ACD/KOC (pH 5.5): 1053.64
ACD/LogD (pH 7.4): 3.03
ACD/BCF (pH 7.4): 117.25
ACD/KOC (pH 7.4): 1053.64
Polar Surface Area: 70 Å2
Polarizability: 31.7±0.5 10-24cm3
Surface Tension: 48.6±7.0 dyne/cm
Molar Volume: 235.6±7.0 cm3

Click to predict properties on the Chemicalize site


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