ChemSpider 2D Image | 1-(3-Oxetanyl)-4-(4,4,6-trimethyl-1,3,2-dioxaborinan-2-yl)-1H-pyrazole | C12H19BN2O3

1-(3-Oxetanyl)-4-(4,4,6-trimethyl-1,3,2-dioxaborinan-2-yl)-1H-pyrazole

  • Molecular FormulaC12H19BN2O3
  • Average mass250.102 Da
  • Monoisotopic mass250.148880 Da
  • ChemSpider ID46756377

More details:

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

1-(3-Oxetanyl)-4-(4,4,6-trimethyl-1,3,2-dioxaborinan-2-yl)-1H-pyrazol [German] [ACD/IUPAC Name]
1-(3-Oxetanyl)-4-(4,4,6-trimethyl-1,3,2-dioxaborinan-2-yl)-1H-pyrazole [ACD/IUPAC Name]
1-(3-Oxétanyl)-4-(4,4,6-triméthyl-1,3,2-dioxaborinan-2-yl)-1H-pyrazole [French] [ACD/IUPAC Name]
1H-Pyrazole, 1-(3-oxetanyl)-4-(4,4,6-trimethyl-1,3,2-dioxaborinan-2-yl)- [ACD/Index Name]
1-(oxetan-3-yl)-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
1339890-99-1 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 400.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.6±3.0 kJ/mol
Flash Point: 196.1±25.9 °C
Index of Refraction: 1.566
Molar Refractivity: 66.2±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 46 Å2
Polarizability: 26.2±0.5 10-24cm3
Surface Tension: 39.7±7.0 dyne/cm
Molar Volume: 203.0±7.0 cm3

Click to predict properties on the Chemicalize site


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