ChemSpider 2D Image | Difluoro(5-{2-[(5-octyl-1H-pyrrol-2-yl-kappaN)methylene]-2H-pyrrol-5-yl-kappaN}pentanoato)boron | C22H31BF2N2O2

Difluoro(5-{2-[(5-octyl-1H-pyrrol-2-yl-κN)methylene]-2H-pyrrol-5-yl-κN}pentanoato)boron

  • Molecular FormulaC22H31BF2N2O2
  • Average mass404.302 Da
  • Monoisotopic mass404.244659 Da
  • ChemSpider ID25056788

More details:






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

Boron, difluoro[2-[(5-octyl-1H-pyrrol-2-yl-κN)methylene]-2H-pyrrole-5-pentanoato-κN1]- [ACD/Index Name]
Difluor(5-{2-[(5-octyl-1H-pyrrol-2-yl-κN)methylen]-2H-pyrrol-5-yl-κN}pentanoato)bor [German] [ACD/IUPAC Name]
Difluoro(5-{2-[(5-octyl-1H-pyrrol-2-yl-κN)méthylène]-2H-pyrrol-5-yl-κN}pentanato)bore [French] [ACD/IUPAC Name]
Difluoro(5-{2-[(5-octyl-1H-pyrrol-2-yl-κN)methylene]-2H-pyrrol-5-yl-κN}pentanoato)boron [ACD/IUPAC Name]
difluoro(5-{2-[(5-octyl-1H-pyrrol-2-yl-κN)methylidene]-2H-pyrrol-5-yl-κN}pentanoato)boron
12-(4-carboxybutyl)-2,2-difluoro-4-octyl-1λ5,3-diaza-2-boratricyclo[7.3.0.03,7]dodeca-1(12),4,6,8,10-pentaen-1-ylium-2-uide
12-(4-carboxybutyl)-2,2-difluoro-4-octyl-1λ⁵,3-diaza-2-boratricyclo[7.3.0.0³,⁷]dodeca-1(12),4,6,8,10-pentaen-1-ylium-2-uide

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 12
#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: 45 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site






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