ChemSpider 2D Image | (2-Isopropyl-6H-cyclopenta[5,6]pyrido[2,3-d]pyrimidin-8-yl)boronic acid | C13H14BN3O2

(2-Isopropyl-6H-cyclopenta[5,6]pyrido[2,3-d]pyrimidin-8-yl)boronic acid

  • Molecular FormulaC13H14BN3O2
  • Average mass255.080 Da
  • Monoisotopic mass255.117905 Da
  • ChemSpider ID96304901

More details:

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

(2-Isopropyl-6H-cyclopenta[5,6]pyrido[2,3-d]pyrimidin-8-yl)boronic acid [ACD/IUPAC Name]
(2-Isopropyl-6H-cyclopenta[5,6]pyrido[2,3-d]pyrimidin-8-yl)borsäure [German] [ACD/IUPAC Name]
Acide (2-isopropyl-6H-cyclopenta[5,6]pyrido[2,3-d]pyrimidin-8-yl)boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[2-(1-methylethyl)-6H-cyclopenta[5,6]pyrido[2,3-d]pyrimidin-8-yl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 445.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 74.1±3.0 kJ/mol
Flash Point: 223.1±31.5 °C
Index of Refraction: 1.645
Molar Refractivity: 69.6±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.48
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: 79 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 68.4±5.0 dyne/cm
Molar Volume: 192.1±5.0 cm3

Click to predict properties on the Chemicalize site


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