ChemSpider 2D Image | (1xi)-1,4-Anhydro-1-(6-carbamoyl-2-pyridinyl)-D-ribitol | C11H14N2O5

(1ξ)-1,4-Anhydro-1-(6-carbamoyl-2-pyridinyl)-D-ribitol

  • Molecular FormulaC11H14N2O5
  • Average mass254.239 Da
  • Monoisotopic mass254.090271 Da
  • ChemSpider ID24658953

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

(1ξ)-1,4-Anhydro-1-(6-carbamoyl-2-pyridinyl)-D-ribitol [German] [ACD/IUPAC Name]
(1ξ)-1,4-Anhydro-1-(6-carbamoyl-2-pyridinyl)-D-ribitol [ACD/IUPAC Name]
(1ξ)-1,4-Anhydro-1-(6-carbamoyl-2-pyridinyl)-D-ribitol [French] [ACD/IUPAC Name]
D-Ribitol, 1-C-[6-(aminocarbonyl)-2-pyridinyl]-1,4-anhydro-, (1ξ)- [ACD/Index Name]
117134-30-2 [RN]
6-(3,4-Dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-pyridine-2-carboxylic acid amide

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

Density: 1.5±0.1 g/cm3
Boiling Point: 581.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.5±3.0 kJ/mol
Flash Point: 305.6±30.1 °C
Index of Refraction: 1.643
Molar Refractivity: 60.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -1.22
ACD/LogD (pH 5.5): -1.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.58
ACD/LogD (pH 7.4): -1.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.58
Polar Surface Area: 126 Å2
Polarizability: 24.2±0.5 10-24cm3
Surface Tension: 78.5±3.0 dyne/cm
Molar Volume: 168.4±3.0 cm3

Click to predict properties on the Chemicalize site


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