ChemSpider 2D Image | 1-(beta-D-Glucopyranosyluronosyl)-3-[(2S)-1-nitroso-2-pyrrolidinyl]pyridinium | C15H19N3O7

1-(β-D-Glucopyranosyluronosyl)-3-[(2S)-1-nitroso-2-pyrrolidinyl]pyridinium

  • Molecular FormulaC15H19N3O7
  • Average mass353.327 Da
  • Monoisotopic mass353.122314 Da
  • ChemSpider ID26324557

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

1-(β-D-Glucopyranosyluronosyl)-3-[(2S)-1-nitroso-2-pyrrolidinyl]pyridinium [German] [ACD/IUPAC Name]
1-(β-D-Glucopyranosyluronosyl)-3-[(2S)-1-nitroso-2-pyrrolidinyl]pyridinium [ACD/IUPAC Name]
1-(β-D-Glucopyranosyluronosyl)-3-[(2S)-1-nitroso-2-pyrrolidinyl]pyridinium [French] [ACD/IUPAC Name]
864071-82-9 [RN]
Pyridinium, 1-β-D-glucopyranuronosyl-3-[(2S)-1-nitroso-2-pyrrolidinyl]-, inner salt [ACD/Index Name]
[864071-82-9] [RN]
MFCD09841101
N'-NITROSONORNICOTINE N-β-D-GLUCURONIDE
N'-Nitrosonornicotine-N-b-D-glucuronide
N-Nitrosonornicotine-N-b-D-glucuronide - Mixture Of Diastereomers
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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: 10
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -5.17
ACD/LogD (pH 5.5): -4.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 147 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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