ChemSpider 2D Image | (2E,10E)-1-Hydroxy-6-methyl-4-oxo-1,6,7,8,9,11a,12,13,14,14a-decahydro-4H-cyclopenta[f]oxacyclotridecin-13-yl N,N-dimethylglycinate | C20H31NO5

(2E,10E)-1-Hydroxy-6-methyl-4-oxo-1,6,7,8,9,11a,12,13,14,14a-decahydro-4H-cyclopenta[f]oxacyclotridecin-13-yl N,N-dimethylglycinate

  • Molecular FormulaC20H31NO5
  • Average mass365.464 Da
  • Monoisotopic mass365.220215 Da
  • ChemSpider ID128912905

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E,10E)-1-Hydroxy-6-methyl-4-oxo-1,6,7,8,9,11a,12,13,14,14a-decahydro-4H-cyclopenta[f]oxacyclotridecin-13-yl N,N-dimethylglycinate [ACD/IUPAC Name]
(2E,10E)-1-Hydroxy-6-methyl-4-oxo-1,6,7,8,9,11a,12,13,14,14a-decahydro-4H-cyclopenta[f]oxacyclotridecin-13-yl-N,N-dimethylglycinat [German] [ACD/IUPAC Name]
Glycine, N,N-dimethyl-, (2E,10E)-1,6,7,8,9,11a,12,13,14,14a-decahydro-1-hydroxy-6-methyl-4-oxo-4H-cyclopent[f]oxacyclotridecin-13-yl ester [ACD/Index Name]
N,N-Diméthylglycinate de (2E,10E)-1-hydroxy-6-méthyl-4-oxo-1,6,7,8,9,11a,12,13,14,14a-décahydro-4H-cyclopenta[f]oxacyclotridécin-13-yle [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 529.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 92.5±6.0 kJ/mol
Flash Point: 273.7±30.1 °C
Index of Refraction: 1.535
Molar Refractivity: 99.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.31
ACD/LogD (pH 5.5): 0.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.80
ACD/LogD (pH 7.4): 2.06
ACD/BCF (pH 7.4): 19.75
ACD/KOC (pH 7.4): 261.76
Polar Surface Area: 76 Å2
Polarizability: 39.4±0.5 10-24cm3
Surface Tension: 45.9±5.0 dyne/cm
Molar Volume: 319.4±5.0 cm3

Click to predict properties on the Chemicalize site


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