ChemSpider 2D Image | (3S)-3-{[(2R)-2-Cyclohexyl-2-hydroxy-2-phenylacetyl]oxy}-1,1-dimethylpyrrolidinium bromide | C20H30BrNO3

(3S)-3-{[(2R)-2-Cyclohexyl-2-hydroxy-2-phenylacetyl]oxy}-1,1-dimethylpyrrolidinium bromide

  • Molecular FormulaC20H30BrNO3
  • Average mass412.361 Da
  • Monoisotopic mass411.140900 Da
  • ChemSpider ID19259954

  • Charge - Charge

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3S)-3-{[(2R)-2-Cyclohexyl-2-hydroxy-2-phenylacetyl]oxy}-1,1-dimethylpyrrolidinium bromide [ACD/IUPAC Name]
(3S)-3-{[(2R)-2-Cyclohexyl-2-hydroxy-2-phenylacetyl]oxy}-1,1-dimethylpyrrolidiniumbromid [German] [ACD/IUPAC Name]
Bromure de (3S)-3-{[(2R)-2-cyclohexyl-2-hydroxy-2-phénylacétyl]oxy}-1,1-diméthylpyrrolidinium [French] [ACD/IUPAC Name]
Pyrrolidinium, 3-[[(2R)-2-cyclohexyl-2-hydroxy-2-phenylacetyl]oxy]-1,1-dimethyl-, bromide, (3S)- (1:1) [ACD/Index Name]
3734-12-1 [RN]
hexopyrronium bromide [INN]
UNII-AP73B5SGYV

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: 6
#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: 47 Å2
Polarizability:
Surface Tension:
Molar Volume:

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