ChemSpider 2D Image | Ascorbyl stearate | C24H42O7

Ascorbyl stearate

  • Molecular FormulaC24H42O7
  • Average mass442.586 Da
  • Monoisotopic mass442.293060 Da
  • ChemSpider ID18619275

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S)-2-[(2R)-3,4-Dihydroxy-5-oxo-2,5-dihydro-2-furanyl]-2-hydroxyethyl stearate [ACD/IUPAC Name]
(2S)-2-[(2R)-3,4-Dihydroxy-5-oxo-2,5-dihydro-2-furanyl]-2-hydroxyethylstearat [German] [ACD/IUPAC Name]
(2S)-2-[(2R)-3,4-dihydroxy-5-oxo-2,5-dihydrofuran-2-yl]-2-hydroxyethyl octadecanoate
(2S)-2-[(2R)-3,4-dihydroxy-5-oxo-2,5-dihydrofuran-2-yl]-2-hydroxyethyl octadecanoate (non-preferred name)
(2S)-2-[(2R)-3,4-Dihydroxy-5-oxo-2,5-dihydrofuran-2-yl]-2-hydroxyethyl stearate (non-preferred name)
10605-09-1 [RN]
234-231-5 [EINECS]
6-O-Stearoyl-L-ascorbic Acid
6-o-stearylascorbic acid
6-O-Stearyl-L-ascorbic acid
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 536.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 93.4±6.0 kJ/mol
Flash Point: 168.5±23.6 °C
Index of Refraction: 1.517
Molar Refractivity: 118.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 1
ACD/LogP: 7.13
ACD/LogD (pH 5.5): 4.64
ACD/BCF (pH 5.5): 800.07
ACD/KOC (pH 5.5): 1429.26
ACD/LogD (pH 7.4): 3.06
ACD/BCF (pH 7.4): 21.06
ACD/KOC (pH 7.4): 37.63
Polar Surface Area: 113 Å2
Polarizability: 47.1±0.5 10-24cm3
Surface Tension: 49.0±3.0 dyne/cm
Molar Volume: 393.2±3.0 cm3

Click to predict properties on the Chemicalize site


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