ChemSpider 2D Image | (1E)-N-{(4R,5S)-2,2,8,8-Tetramethyl-4-[(1E)-1-pentadecen-1-yl]-3,7-dioxa-2,8-disilanonan-5-yl}hexadecanimidic acid | C40H83NO3Si2

(1E)-N-{(4R,5S)-2,2,8,8-Tetramethyl-4-[(1E)-1-pentadecen-1-yl]-3,7-dioxa-2,8-disilanonan-5-yl}hexadecanimidic acid

  • Molecular FormulaC40H83NO3Si2
  • Average mass682.263 Da
  • Monoisotopic mass681.591125 Da
  • ChemSpider ID24606573

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1E)-N-{(4R,5S)-2,2,8,8-Tetramethyl-4-[(1E)-1-pentadecen-1-yl]-3,7-dioxa-2,8-disilanonan-5-yl}hexadecanimidic acid [ACD/IUPAC Name]
(1E)-N-{(4R,5S)-2,2,8,8-Tetramethyl-4-[(1E)-1-pentadecen-1-yl]-3,7-dioxa-2,8-disilanonan-5-yl}hexadecanimidsäure [German] [ACD/IUPAC Name]
Acide (1E)-N-{(4R,5S)-2,2,8,8-tétraméthyl-4-[(1E)-1-pentadécén-1-yl]-3,7-dioxa-2,8-disilanonan-5-yl}hexadécanimidique [French] [ACD/IUPAC Name]
Hexadecanimidic acid, N-[(1S,2R,3E)-2-[(trimethylsilyl)oxy]-1-[[(trimethylsilyl)oxy]methyl]-3-heptadecen-1-yl]-, (1E)- [ACD/Index Name]
1,3-DI-O-TRIMETHYLSILYL-N-HEXADECANOYL-SPHINGOSINE

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

Density: 0.9±0.1 g/cm3
Boiling Point: 671.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.7 mmHg at 25°C
Enthalpy of Vaporization: 112.8±6.0 kJ/mol
Flash Point: 359.7±34.3 °C
Index of Refraction: 1.465
Molar Refractivity: 210.4±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 34
#Rule of 5 Violations: 2
ACD/LogP: 18.98
ACD/LogD (pH 5.5): 16.78
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 16.79
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 51 Å2
Polarizability: 83.4±0.5 10-24cm3
Surface Tension: 27.9±7.0 dyne/cm
Molar Volume: 761.6±7.0 cm3

Click to predict properties on the Chemicalize site


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