Found 1 result

Search term: UMRMEUOEFMNZRM (Found by InChIKey (skeleton match))

ChemSpider 2D Image | (2R,3R,4S,5R,6E)-3,4,5-Trihydroxy-N-[2-(mesityloxy)ethyl]-2-methoxy-8,8-dimethyl-6-nonenamide | C23H37NO6

(2R,3R,4S,5R,6E)-3,4,5-Trihydroxy-N-[2-(mesityloxy)ethyl]-2-methoxy-8,8-dimethyl-6-nonenamide

  • Molecular FormulaC23H37NO6
  • Average mass423.543 Da
  • Monoisotopic mass423.262085 Da
  • ChemSpider ID26329394
  • 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

(2r,3r,4s,5r,6e)-3,4,5-Trihydroxy-2-Methoxy-8,8-Dimethyl-N-[2-(2,4,6-Trimethylphenoxy)ethyl]non-6-Enamide
(2R,3R,4S,5R,6E)-3,4,5-Trihydroxy-N-[2-(mesityloxy)ethyl]-2-methoxy-8,8-dimethyl-6-nonenamid [German] [ACD/IUPAC Name]
(2R,3R,4S,5R,6E)-3,4,5-Trihydroxy-N-[2-(mesityloxy)ethyl]-2-methoxy-8,8-dimethyl-6-nonenamide [ACD/IUPAC Name]
(2R,3R,4S,5R,6E)-3,4,5-Trihydroxy-N-[2-(mésityloxy)éthyl]-2-méthoxy-8,8-diméthyl-6-nonénamide [French] [ACD/IUPAC Name]
Y02

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 649.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 100.6±3.0 kJ/mol
Flash Point: 346.5±31.5 °C
Index of Refraction: 1.536
Molar Refractivity: 117.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 4.63
ACD/LogD (pH 5.5): 3.06
ACD/BCF (pH 5.5): 125.11
ACD/KOC (pH 5.5): 1103.69
ACD/LogD (pH 7.4): 3.06
ACD/BCF (pH 7.4): 125.11
ACD/KOC (pH 7.4): 1103.69
Polar Surface Area: 108 Å2
Polarizability: 46.6±0.5 10-24cm3
Surface Tension: 43.7±3.0 dyne/cm
Molar Volume: 376.8±3.0 cm3

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