ChemSpider 2D Image | 1-(3-Oxetanyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole | C12H19BN2O3


  • Molecular FormulaC12H19BN2O3
  • Average mass250.102 Da
  • Monoisotopic mass250.148880 Da
  • ChemSpider ID28467485

More details:

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

1-(3-Oxetanyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol [German] [ACD/IUPAC Name]
1-(3-Oxetanyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole [ACD/IUPAC Name]
1-(3-Oxétanyl)-5-(4,4,5,5-tétraméthyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole [French] [ACD/IUPAC Name]
1H-Pyrazole, 1-(3-oxetanyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- [ACD/Index Name]
(±)-4-(Trans-2-(trifluoromethyl)cyclopropyl)benzoic acid
1-(3-Oxetanyl)-1H-pyrazole-5-boronic acid pinacol ester
1-(3-Oxetanyl)-1H-pyrazole-5-boronic acid, pinacol ester
1315280-58-0 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 384.7±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.9±3.0 kJ/mol
Flash Point: 186.4±25.1 °C
Index of Refraction: 1.554
Molar Refractivity: 66.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations:
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: 26.4±0.5 10-24cm3
Surface Tension: 38.5±7.0 dyne/cm
Molar Volume: 207.5±7.0 cm3

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