ChemSpider 2D Image | (4S)-7-Acetyl-4-isopropylpyrido[2,1-c][1,4]oxazine-3,8(1H,4H)-dione | C13H15NO4

(4S)-7-Acetyl-4-isopropylpyrido[2,1-c][1,4]oxazine-3,8(1H,4H)-dione

  • Molecular FormulaC13H15NO4
  • Average mass249.262 Da
  • Monoisotopic mass249.100113 Da
  • ChemSpider ID78437098

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(4S)-7-Acetyl-4-isopropylpyrido[2,1-c][1,4]oxazin-3,8(1H,4H)-dion [German] [ACD/IUPAC Name]
(4S)-7-Acetyl-4-isopropylpyrido[2,1-c][1,4]oxazine-3,8(1H,4H)-dione [ACD/IUPAC Name]
(4S)-7-Acétyl-4-isopropylpyrido[2,1-c][1,4]oxazine-3,8(1H,4H)-dione [French] [ACD/IUPAC Name]
Pyrido[2,1-c][1,4]oxazine-3,8(1H,4H)-dione, 7-acetyl-4-(1-methylethyl)-, (4S)- [ACD/Index Name]
Erinacerin M

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

Density: 1.3±0.1 g/cm3
Boiling Point: 470.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.3±3.0 kJ/mol
Flash Point: 238.3±28.7 °C
Index of Refraction: 1.557
Molar Refractivity: 63.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.10
ACD/LogD (pH 5.5): 0.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 28.37
ACD/LogD (pH 7.4): 0.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 28.37
Polar Surface Area: 64 Å2
Polarizability: 25.1±0.5 10-24cm3
Surface Tension: 47.5±5.0 dyne/cm
Molar Volume: 197.2±5.0 cm3

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