ChemSpider 2D Image | (3R,4Z,6E,8E,10E)-3-Hydroxy-N-(2-hydroxy-5-oxo-1-cyclopenten-1-yl)-8-methyl-4,6,8,10-tridecatetraenamide | C19H25NO4

(3R,4Z,6E,8E,10E)-3-Hydroxy-N-(2-hydroxy-5-oxo-1-cyclopenten-1-yl)-8-methyl-4,6,8,10-tridecatetraenamide

  • Molecular FormulaC19H25NO4
  • Average mass331.406 Da
  • Monoisotopic mass331.178345 Da
  • ChemSpider ID59702327

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R,4Z,6E,8E,10E)-3-Hydroxy-N-(2-hydroxy-5-oxo-1-cyclopenten-1-yl)-8-methyl-4,6,8,10-tridecatetraenamid [German] [ACD/IUPAC Name]
(3R,4Z,6E,8E,10E)-3-Hydroxy-N-(2-hydroxy-5-oxo-1-cyclopenten-1-yl)-8-methyl-4,6,8,10-tridecatetraenamide [ACD/IUPAC Name]
(3R,4Z,6E,8E,10E)-3-Hydroxy-N-(2-hydroxy-5-oxo-1-cyclopentén-1-yl)-8-méthyl-4,6,8,10-tridécatétraénamide [French] [ACD/IUPAC Name]
4,6,8,10-Tridecatetraenamide, 3-hydroxy-N-(2-hydroxy-5-oxo-1-cyclopenten-1-yl)-8-methyl-, (3R,4Z,6E,8E,10E)- [ACD/Index Name]
E'4-Z-annimycin'

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

Density: 1.2±0.1 g/cm3
Boiling Point: 582.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.7 mmHg at 25°C
Enthalpy of Vaporization: 100.0±6.0 kJ/mol
Flash Point: 306.0±30.1 °C
Index of Refraction: 1.571
Molar Refractivity: 93.8±0.4 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.72
ACD/LogD (pH 5.5): 0.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.05
ACD/LogD (pH 7.4): -1.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 87 Å2
Polarizability: 37.2±0.5 10-24cm3
Surface Tension: 49.9±5.0 dyne/cm
Molar Volume: 285.5±5.0 cm3

Click to predict properties on the Chemicalize site


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