ChemSpider 2D Image | 3R-Hydroxydecanoyl-S-N-acetyl cysteamine | C14H27NO3S

3R-Hydroxydecanoyl-S-N-acetyl cysteamine

  • Molecular FormulaC14H27NO3S
  • Average mass289.434 Da
  • Monoisotopic mass289.171173 Da
  • ChemSpider ID27289274

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-3-Hydroxydécanethioate de S-(2-acétamidoéthyle) [French] [ACD/IUPAC Name]
3R-Hydroxydecanoyl-S-N-acetyl cysteamine
Decanethioic acid, 3-hydroxy-, S-[2-(acetylamino)ethyl] ester, (3R)- [ACD/Index Name]
S-(2-Acetamidoethyl) (3R)-3-hydroxydecanethioate [ACD/IUPAC Name]
S-(2-Acetamidoethyl)-(3R)-3-hydroxydecanthioat [German] [ACD/IUPAC Name]
S-[2-(Acetylamino)ethyl] (3r)-3-Hydroxydecanethioate
KBP

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

Density: 1.1±0.1 g/cm3
Boiling Point: 469.3±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 84.4±6.0 kJ/mol
Flash Point: 237.6±24.6 °C
Index of Refraction: 1.495
Molar Refractivity: 80.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 2.67
ACD/LogD (pH 5.5): 2.79
ACD/BCF (pH 5.5): 78.16
ACD/KOC (pH 5.5): 788.12
ACD/LogD (pH 7.4): 2.79
ACD/BCF (pH 7.4): 78.16
ACD/KOC (pH 7.4): 788.12
Polar Surface Area: 92 Å2
Polarizability: 31.7±0.5 10-24cm3
Surface Tension: 40.4±3.0 dyne/cm
Molar Volume: 274.5±3.0 cm3

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