ChemSpider 2D Image | (5S,6E,8S,9E,13S,14R)-5-Hydroxy-8-methoxy-5,9,13,14-tetramethyl(4,8,12-~13~C_3_)oxacyclotetradeca-6,9-dien-2-one | C1513C3H30O4

(5S,6E,8S,9E,13S,14R)-5-Hydroxy-8-methoxy-5,9,13,14-tetramethyl(4,8,12-13C3)oxacyclotetradeca-6,9-dien-2-one

  • Molecular FormulaC1513C3H30O4
  • Average mass313.406 Da
  • Monoisotopic mass313.224487 Da
  • ChemSpider ID8956795

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 4 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(5S,6E,8S,9E,13S,14R)-5-Hydroxy-8-methoxy-5,9,13,14-tetramethyl(4,8,12-13C3)oxacyclotetradeca-6,9-dien-2-on [German] [ACD/IUPAC Name]
(5S,6E,8S,9E,13S,14R)-5-Hydroxy-8-methoxy-5,9,13,14-tetramethyl(4,8,12-13C3)oxacyclotetradeca-6,9-dien-2-one [ACD/IUPAC Name]
(5S,6E,8S,9E,13S,14R)-5-Hydroxy-8-méthoxy-5,9,13,14-tétraméthyl(4,8,12-13C3)oxacyclotétradéca-6,9-dién-2-one [French] [ACD/IUPAC Name]
Oxacyclotetradeca-6,9-dien-2-one-4,8,12-13C3, 5-hydroxy-8-methoxy-5,9,13,14-tetramethyl-, (5S,6E,8S,9E,13S,14R)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.495
Molar Refractivity: 88.0±0.4 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 34.9±0.5 10-24cm3
Surface Tension: 37.4±5.0 dyne/cm
Molar Volume: 301.6±5.0 cm3

Click to predict properties on the Chemicalize site


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