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Search term: MWFWGXGLRBDFOQ-WJDWOHSUSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | 4-Methoxydehydrocyclopeptin | C18H16N2O3

4-Methoxydehydrocyclopeptin

  • Molecular FormulaC18H16N2O3
  • Average mass308.331 Da
  • Monoisotopic mass308.116089 Da
  • ChemSpider ID58838087
  • Double-bond stereo - Double-bond stereo


More details:






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

(3Z)-2-Hydroxy-3-(4-methoxybenzyliden)-4-methyl-3,4-dihydro-5H-1,4-benzodiazepin-5-on [German] [ACD/IUPAC Name]
(3Z)-2-Hydroxy-3-(4-methoxybenzylidene)-4-methyl-3,4-dihydro-5H-1,4-benzodiazepin-5-one [ACD/IUPAC Name]
(3Z)-2-Hydroxy-3-(4-méthoxybenzylidène)-4-méthyl-3,4-dihydro-5H-1,4-benzodiazépin-5-one [French] [ACD/IUPAC Name]
4-Methoxydehydrocyclopeptin
5H-1,4-Benzodiazepin-5-one, 3,4-dihydro-2-hydroxy-3-[(4-methoxyphenyl)methylene]-4-methyl-, (3Z)- [ACD/Index Name]
4'-methoxydehydrocyclopeptin
4'-methoxydehydrocyclopeptine
58J

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

Density: 1.2±0.1 g/cm3
Boiling Point: 572.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.3±3.0 kJ/mol
Flash Point: 300.0±32.9 °C
Index of Refraction: 1.613
Molar Refractivity: 87.6±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.41
ACD/LogD (pH 5.5): 2.29
ACD/BCF (pH 5.5): 32.36
ACD/KOC (pH 5.5): 416.52
ACD/LogD (pH 7.4): 2.28
ACD/BCF (pH 7.4): 31.72
ACD/KOC (pH 7.4): 408.37
Polar Surface Area: 62 Å2
Polarizability: 34.7±0.5 10-24cm3
Surface Tension: 45.7±7.0 dyne/cm
Molar Volume: 251.6±7.0 cm3

Click to predict properties on the Chemicalize site






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