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Search term: 24694048 (Found by CSID)
ChemSpider 2D Image | {1-(2-Hydroxyethyl)-5-[(3-methylbutanoyl)carbamoyl]-4-oxo-1,4-dihydro-2-pyridinyl}(phenyl)methyl acetate | C22H26N2O6

{1-(2-Hydroxyethyl)-5-[(3-methylbutanoyl)carbamoyl]-4-oxo-1,4-dihydro-2-pyridinyl}(phenyl)methyl acetate

  • Molecular FormulaC22H26N2O6
  • Average mass414.452 Da
  • Monoisotopic mass414.179077 Da
  • ChemSpider ID24694048

More details:

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

{1-(2-Hydroxyethyl)-5-[(3-methylbutanoyl)carbamoyl]-4-oxo-1,4-dihydro-2-pyridinyl}(phenyl)methyl acetate [ACD/IUPAC Name]
{1-(2-Hydroxyethyl)-5-[(3-methylbutanoyl)carbamoyl]-4-oxo-1,4-dihydro-2-pyridinyl}(phenyl)methyl-acetat [German] [ACD/IUPAC Name]
3-Pyridinecarboxamide, 6-[(acetyloxy)phenylmethyl]-1,4-dihydro-1-(2-hydroxyethyl)-N-(3-methyl-1-oxobutyl)-4-oxo- [ACD/Index Name]
Acétate de {1-(2-hydroxyéthyl)-5-[(3-méthylbutanoyl)carbamoyl]-4-oxo-1,4-dihydro-2-pyridinyl}(phényl)méthyle [French] [ACD/IUPAC Name]
Berkeleyamide C

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

Density: 1.3±0.1 g/cm3
Boiling Point: 601.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.1±3.0 kJ/mol
Flash Point: 317.5±31.5 °C
Index of Refraction: 1.569
Molar Refractivity: 108.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 1.33
ACD/LogD (pH 5.5): 1.34
ACD/BCF (pH 5.5): 6.12
ACD/KOC (pH 5.5): 126.64
ACD/LogD (pH 7.4): 0.97
ACD/BCF (pH 7.4): 2.60
ACD/KOC (pH 7.4): 53.77
Polar Surface Area: 113 Å2
Polarizability: 43.0±0.5 10-24cm3
Surface Tension: 52.8±3.0 dyne/cm
Molar Volume: 330.8±3.0 cm3

Click to predict properties on the Chemicalize site


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