Found 4 results

Search term: KOZFLFLIXRVHCR (Found by InChIKey (skeleton match))
ChemSpider 2D Image | Methyl [(3S,7S)-3-(3,4-dimethoxybenzyl)-5-oxohexahydro-5H-[1,3]oxazolo[3,2-a]pyridin-7-yl]acetate | C19H25NO6

Methyl [(3S,7S)-3-(3,4-dimethoxybenzyl)-5-oxohexahydro-5H-[1,3]oxazolo[3,2-a]pyridin-7-yl]acetate

  • Molecular FormulaC19H25NO6
  • Average mass363.405 Da
  • Monoisotopic mass363.168182 Da
  • ChemSpider ID30651145

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

[(3S,7S)-3-(3,4-Diméthoxybenzyl)-5-oxohexahydro-5H-[1,3]oxazolo[3,2-a]pyridin-7-yl]acétate de méthyle [French] [ACD/IUPAC Name]
5H-Oxazolo[3,2-a]pyridine-7-acetic acid, 3-[(3,4-dimethoxyphenyl)methyl]hexahydro-5-oxo-, methyl ester, (3S,7S)- [ACD/Index Name]
Methyl [(3S,7S)-3-(3,4-dimethoxybenzyl)-5-oxohexahydro-5H-[1,3]oxazolo[3,2-a]pyridin-7-yl]acetate [ACD/IUPAC Name]
Methyl-[(3S,7S)-3-(3,4-dimethoxybenzyl)-5-oxohexahydro-5H-[1,3]oxazolo[3,2-a]pyridin-7-yl]acetat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 511.8±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.3±3.0 kJ/mol
Flash Point: 263.3±27.3 °C
Index of Refraction: 1.558
Molar Refractivity: 93.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.00
ACD/LogD (pH 5.5): 1.54
ACD/BCF (pH 5.5): 8.78
ACD/KOC (pH 5.5): 164.76
ACD/LogD (pH 7.4): 1.54
ACD/BCF (pH 7.4): 8.78
ACD/KOC (pH 7.4): 164.76
Polar Surface Area: 74 Å2
Polarizability: 37.2±0.5 10-24cm3
Surface Tension: 50.0±5.0 dyne/cm
Molar Volume: 291.1±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement