Found 259 results

Search term: MF = 'C_{14}H_{9}BClN_{3}O_{2}'
ChemSpider 2D Image | {2-[(2-Chloropyrrolo[2,1-f][1,2,4]triazin-7-yl)ethynyl]phenyl}boronic acid | C14H9BClN3O2

{2-[(2-Chloropyrrolo[2,1-f][1,2,4]triazin-7-yl)ethynyl]phenyl}boronic acid

  • Molecular FormulaC14H9BClN3O2
  • Average mass297.504 Da
  • Monoisotopic mass297.047638 Da
  • ChemSpider ID83722111

More details:

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

{2-[(2-Chloropyrrolo[2,1-f][1,2,4]triazin-7-yl)ethynyl]phenyl}boronic acid [ACD/IUPAC Name]
{2-[(2-Chlorpyrrolo[2,1-f][1,2,4]triazin-7-yl)ethinyl]phenyl}borsäure [German] [ACD/IUPAC Name]
Acide {2-[(2-chloropyrrolo[2,1-f][1,2,4]triazin-7-yl)éthynyl]phényl}boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[2-[2-(2-chloropyrrolo[2,1-f][1,2,4]triazin-7-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: 3.54
ACD/LogD (pH 5.5): 3.18
ACD/BCF (pH 5.5): 153.46
ACD/KOC (pH 5.5): 1276.86
ACD/LogD (pH 7.4): 3.13
ACD/BCF (pH 7.4): 135.32
ACD/KOC (pH 7.4): 1125.90
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


Advertisement