ChemSpider 2D Image | trans-1-(Cycloheptylmethyl)-4-{[(2,7-dichloro-9H-xanthen-9-yl)carbonyl]amino}-1-methylpiperidinium | C28H35Cl2N2O2

trans-1-(Cycloheptylmethyl)-4-{[(2,7-dichloro-9H-xanthen-9-yl)carbonyl]amino}-1-methylpiperidinium

  • Molecular FormulaC28H35Cl2N2O2
  • Average mass502.495 Da
  • Monoisotopic mass501.207001 Da
  • ChemSpider ID34526436

  • Charge - Charge

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Piperidinium, 1-(cycloheptylmethyl)-4-[[(2,7-dichloro-9H-xanthen-9-yl)carbonyl]amino]-1-methyl-, trans- [ACD/Index Name]
trans-1-(Cycloheptylmethyl)-4-{[(2,7-dichlor-9H-xanthen-9-yl)carbonyl]amino}-1-methylpiperidinium [German] [ACD/IUPAC Name]
trans-1-(Cycloheptylmethyl)-4-{[(2,7-dichloro-9H-xanthen-9-yl)carbonyl]amino}-1-methylpiperidinium [ACD/IUPAC Name]
trans-1-(Cycloheptylméthyl)-4-{[(2,7-dichloro-9H-xanthén-9-yl)carbonyl]amino}-1-méthylpipéridinium [French] [ACD/IUPAC Name]

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

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: 4
#Rule of 5 Violations: 1
ACD/LogP: 2.43
ACD/LogD (pH 5.5): 2.00
ACD/BCF (pH 5.5): 19.45
ACD/KOC (pH 5.5): 291.26
ACD/LogD (pH 7.4): 2.00
ACD/BCF (pH 7.4): 19.45
ACD/KOC (pH 7.4): 291.26
Polar Surface Area: 38 Å2
Polarizability:
Surface Tension:
Molar Volume:

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