Found 259 results

Search term: MF = 'C_{14}H_{9}BClN_{3}O_{2}'
ChemSpider 2D Image | {3-[(5-Chloropyrazolo[1,5-a]pyrimidin-3-yl)ethynyl]phenyl}boronic acid | C14H9BClN3O2

{3-[(5-Chloropyrazolo[1,5-a]pyrimidin-3-yl)ethynyl]phenyl}boronic acid

  • Molecular FormulaC14H9BClN3O2
  • Average mass297.504 Da
  • Monoisotopic mass297.047638 Da
  • ChemSpider ID82996211

More details:

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

{3-[(5-Chloropyrazolo[1,5-a]pyrimidin-3-yl)ethynyl]phenyl}boronic acid [ACD/IUPAC Name]
{3-[(5-Chlorpyrazolo[1,5-a]pyrimidin-3-yl)ethinyl]phenyl}borsäure [German] [ACD/IUPAC Name]
Acide {3-[(5-chloropyrazolo[1,5-a]pyrimidin-3-yl)éthynyl]phényl}boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[3-[2-(5-chloropyrazolo[1,5-a]pyrimidin-3-yl)ethynyl]phenyl]- [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.648
Molar Refractivity: 80.6±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.87
ACD/LogD (pH 5.5): 2.80
ACD/BCF (pH 5.5): 78.60
ACD/KOC (pH 5.5): 790.28
ACD/LogD (pH 7.4): 2.66
ACD/BCF (pH 7.4): 57.87
ACD/KOC (pH 7.4): 581.86
Polar Surface Area: 71 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 52.7±7.0 dyne/cm
Molar Volume: 221.5±7.0 cm3

Click to predict properties on the Chemicalize site


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