Found 16 results

Search term: MF = 'C_{43}H_{76}O_{10}'
ChemSpider 2D Image | (5S)-3-[(2R,9E,13R)-2,13-Bis(methoxymethoxy)-13-{(2R,2'R,5R,5'R)-5'-[(1S)-1-(methoxymethoxy)undecyl]octahydro-2,2'-bifuran-5-yl}-9-tridecen-1-yl]-5-methyl-2(5H)-furanone | C43H76O10

(5S)-3-[(2R,9E,13R)-2,13-Bis(methoxymethoxy)-13-{(2R,2'R,5R,5'R)-5'-[(1S)-1-(methoxymethoxy)undecyl]octahydro-2,2'-bifuran-5-yl}-9-tridecen-1-yl]-5-methyl-2(5H)-furanone

  • Molecular FormulaC43H76O10
  • Average mass753.057 Da
  • Monoisotopic mass752.543823 Da
  • ChemSpider ID9910025

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(5S)-3-[(2R,9E,13R)-2,13-Bis(methoxymethoxy)-13-{(2R,2'R,5R,5'R)-5'-[(1S)-1-(methoxymethoxy)undecyl]octahydro-2,2'-bifuran-5-yl}-9-tridecen-1-yl]-5-methyl-2(5H)-furanon [German] [ACD/IUPAC Name]
(5S)-3-[(2R,9E,13R)-2,13-Bis(methoxymethoxy)-13-{(2R,2'R,5R,5'R)-5'-[(1S)-1-(methoxymethoxy)undecyl]octahydro-2,2'-bifuran-5-yl}-9-tridecen-1-yl]-5-methyl-2(5H)-furanone [ACD/IUPAC Name]
(5S)-3-[(2R,9E,13R)-2,13-Bis(méthoxyméthoxy)-13-{(2R,2'R,5R,5'R)-5'-[(1S)-1-(méthoxyméthoxy)undécyl]octahydro-2,2'-bifuran-5-yl}-9-tridécén-1-yl]-5-méthyl-2(5H)-furanone [French] [ACD/IUPAC Name]
2(5H)-Furanone, 3-[(2R,9E,13R)-2,13-bis(methoxymethoxy)-13-[(2R,2'R,5R,5'R)-octahydro-5'-[(1S)-1-(methoxymethoxy)undecyl][2,2'-bifuran]-5-yl]-9-tridecen-1-yl]-5-methyl-, (5S)- [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: 769.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.1±3.0 kJ/mol
Flash Point: 301.0±32.9 °C
Index of Refraction: 1.488
Molar Refractivity: 210.1±0.3 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 33
#Rule of 5 Violations: 3
ACD/LogP: 8.40
ACD/LogD (pH 5.5): 8.51
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1011143.31
ACD/LogD (pH 7.4): 8.51
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1011143.31
Polar Surface Area: 100 Å2
Polarizability: 83.3±0.5 10-24cm3
Surface Tension: 37.8±3.0 dyne/cm
Molar Volume: 729.3±3.0 cm3

Click to predict properties on the Chemicalize site


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