ChemSpider 2D Image | (8Z)-2-[(5E)-5-Hepten-1-yl]-8-(hydroxyimino)-3-methyl-6,7,8,8a-tetrahydro-4H-pyrrolo[2,1-b][1,3]oxazin-4-one | C15H22N2O3

(8Z)-2-[(5E)-5-Hepten-1-yl]-8-(hydroxyimino)-3-methyl-6,7,8,8a-tetrahydro-4H-pyrrolo[2,1-b][1,3]oxazin-4-one

  • Molecular FormulaC15H22N2O3
  • Average mass278.347 Da
  • Monoisotopic mass278.163055 Da
  • ChemSpider ID26600022

  • Double-bond stereo - Double-bond stereo

More details:

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

(8Z)-2-[(5E)-5-Hepten-1-yl]-8-(hydroxyimino)-3-methyl-6,7,8,8a-tetrahydro-4H-pyrrolo[2,1-b][1,3]oxazin-4-on [German] [ACD/IUPAC Name]
(8Z)-2-[(5E)-5-Hepten-1-yl]-8-(hydroxyimino)-3-methyl-6,7,8,8a-tetrahydro-4H-pyrrolo[2,1-b][1,3]oxazin-4-one [ACD/IUPAC Name]
(8Z)-2-[(5E)-5-Heptén-1-yl]-8-(hydroxyimino)-3-méthyl-6,7,8,8a-tétrahydro-4H-pyrrolo[2,1-b][1,3]oxazin-4-one [French] [ACD/IUPAC Name]
4H-Pyrrolo[2,1-b][1,3]oxazine-4,8(8aH)-dione, 2-[(5E)-5-hepten-1-yl]-6,7-dihydro-3-methyl-, 8-oxime, (8Z)- [ACD/Index Name]
Brevioxime

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

Density: 1.2±0.1 g/cm3
Boiling Point: 486.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 82.4±6.0 kJ/mol
Flash Point: 248.1±28.7 °C
Index of Refraction: 1.572
Molar Refractivity: 76.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.85
ACD/LogD (pH 5.5): 1.71
ACD/BCF (pH 5.5): 11.79
ACD/KOC (pH 5.5): 203.49
ACD/LogD (pH 7.4): 1.71
ACD/BCF (pH 7.4): 11.78
ACD/KOC (pH 7.4): 203.43
Polar Surface Area: 62 Å2
Polarizability: 30.3±0.5 10-24cm3
Surface Tension: 42.8±7.0 dyne/cm
Molar Volume: 231.9±7.0 cm3

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