ChemSpider 2D Image | chaetomugilin L | C23H29ClO4

chaetomugilin L

  • Molecular FormulaC23H29ClO4
  • Average mass404.927 Da
  • Monoisotopic mass404.175446 Da
  • ChemSpider ID27024229

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(6aS,8S,9aS)-8-[(2E)-2-Buten-2-yl]-5-chlor-8-methoxy-6a-methyl-3-[(1E,3S)-3-methyl-1-penten-1-yl]-6a,8,9,9a-tetrahydro-6H-furo[2,3-h]isochromen-6-on [German] [ACD/IUPAC Name]
(6aS,8S,9aS)-8-[(2E)-2-Buten-2-yl]-5-chloro-8-methoxy-6a-methyl-3-[(1E,3S)-3-methyl-1-penten-1-yl]-6a,8,9,9a-tetrahydro-6H-furo[2,3-h]isochromen-6-one [ACD/IUPAC Name]
(6aS,8S,9aS)-8-[(2E)-2-Butén-2-yl]-5-chloro-8-méthoxy-6a-méthyl-3-[(1E,3S)-3-méthyl-1-pentén-1-yl]-6a,8,9,9a-tétrahydro-6H-furo[2,3-h]isochromén-6-one [French] [ACD/IUPAC Name]
6H-Furo[2,3-h]-2-benzopyran-6-one, 5-chloro-6a,8,9,9a-tetrahydro-8-methoxy-6a-methyl-3-[(1E,3S)-3-methyl-1-penten-1-yl]-8-[(1E)-1-methyl-1-propen-1-yl]-, (6aS,8S,9aS)- [ACD/Index Name]
chaetomugilin L

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

Density: 1.2±0.1 g/cm3
Boiling Point: 487.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.4±3.0 kJ/mol
Flash Point: 157.5±27.7 °C
Index of Refraction: 1.558
Molar Refractivity: 111.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.65
ACD/LogD (pH 5.5): 3.77
ACD/BCF (pH 5.5): 431.46
ACD/KOC (pH 5.5): 2677.30
ACD/LogD (pH 7.4): 3.77
ACD/BCF (pH 7.4): 431.46
ACD/KOC (pH 7.4): 2677.30
Polar Surface Area: 45 Å2
Polarizability: 44.0±0.5 10-24cm3
Surface Tension: 41.9±5.0 dyne/cm
Molar Volume: 344.2±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement