ChemSpider 2D Image | (4R,12aS)-7-Methoxy-4-methyl-6,8-dioxo-3,4,6,8,12,12a-hexahydro-2H-pyrido[1',2':4,5]pyrazino[2,1-b][1,3]oxazine-9-carboxylic acid | C14H16N2O6

(4R,12aS)-7-Methoxy-4-methyl-6,8-dioxo-3,4,6,8,12,12a-hexahydro-2H-pyrido[1',2':4,5]pyrazino[2,1-b][1,3]oxazine-9-carboxylic acid

  • Molecular FormulaC14H16N2O6
  • Average mass308.287 Da
  • Monoisotopic mass308.100830 Da
  • ChemSpider ID35142291

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4R,12aS)-7-Methoxy-4-methyl-6,8-dioxo-3,4,6,8,12,12a-hexahydro-2H-pyrido[1',2':4,5]pyrazino[2,1-b][1,3]oxazin-9-carbonsäure [German] [ACD/IUPAC Name]
(4R,12aS)-7-Methoxy-4-methyl-6,8-dioxo-3,4,6,8,12,12a-hexahydro-2H-pyrido[1',2':4,5]pyrazino[2,1-b][1,3]oxazine-9-carboxylic acid [ACD/IUPAC Name]
1335210-34-8 [RN]
2H-Pyrido[1',2':4,5]pyrazino[2,1-b][1,3]oxazine-9-carboxylic acid, 3,4,6,8,12,12a-hexahydro-7-methoxy-4-methyl-6,8-dioxo-, (4R,12aS)- [ACD/Index Name]
Acide (4R,12aS)-7-méthoxy-4-méthyl-6,8-dioxo-3,4,6,8,12,12a-hexahydro-2H-pyrido[1',2':4,5]pyrazino[2,1-b][1,3]oxazine-9-carboxylique [French] [ACD/IUPAC Name]
(4R,?12aS)?-3,?4,?6,?8,?12,?12a-?hexahydro-?7-?methoxy-?4-?methyl-?6,?8-?dioxo-?2H-?Pyrido[1',?2':4,?5]?pyrazino[2,?1-?b]?[1,?3]?oxazine-?9-?carboxylic acid
(4R,12aS)-7-Methoxy-4-Methyl-6,8-dioxo-3,4,6,8,12,12a-hexahydro-2H-[1,3]oxazino[3,2-d]pyrido[1,2-a]pyrazine-9-carboxylic acid
(4R,12aS)-7-Methoxy-4-methyl-6; ,8-dioxo-3,4,6,8,12,12a-hexahydr o-2H-[1,3]oxazino[3,2-d]pyrido[1; ,2-a]pyrazine-9-carboxylic acid
MFCD28978321

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 560.8±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±3.3 mmHg at 25°C
    Enthalpy of Vaporization: 92.2±6.0 kJ/mol
    Flash Point: 293.0±30.1 °C
    Index of Refraction: 1.632
    Molar Refractivity: 73.0±0.4 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -2.20
    ACD/LogD (pH 5.5): -1.60
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 2.28
    ACD/LogD (pH 7.4): -3.22
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 96 Å2
    Polarizability: 28.9±0.5 10-24cm3
    Surface Tension: 68.5±5.0 dyne/cm
    Molar Volume: 204.5±5.0 cm3

    Click to predict properties on the Chemicalize site


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