ChemSpider 2D Image | (4R)-3-[(2S)-2-Allyloctanoyl]-4-benzyl-1,3-oxazolidin-2-one | C21H29NO3

(4R)-3-[(2S)-2-Allyloctanoyl]-4-benzyl-1,3-oxazolidin-2-one

  • Molecular FormulaC21H29NO3
  • Average mass343.460 Da
  • Monoisotopic mass343.214752 Da
  • ChemSpider ID31047052

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4R)-3-[(2S)-2-Allyloctanoyl]-4-benzyl-1,3-oxazolidin-2-on [German] [ACD/IUPAC Name]
(4R)-3-[(2S)-2-Allyloctanoyl]-4-benzyl-1,3-oxazolidin-2-one [ACD/IUPAC Name]
(4R)-3-[(2S)-2-Allyloctanoyl]-4-benzyl-1,3-oxazolidin-2-one [French] [ACD/IUPAC Name]
(4R)-4-BENZYL-3-[(2S)-2-(PROP-2-EN-1-YL)OCTANOYL]-1,3-OXAZOLIDIN-2-ONE
2-Oxazolidinone, 3-[(2S)-1-oxo-2-(2-propen-1-yl)octyl]-4-(phenylmethyl)-, (4R)- [ACD/Index Name]
548783-48-8 [RN]
(4R)-3-[(2S)-1-Oxo-2-(2-propenyl)octyl]-4-benzyl-2-oxazolidinone
(R)-3-((S)-2-Allyloctanoyl)-4-benzyloxazolidin-2-one
1329497-20-2 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 482.8±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.8±3.0 kJ/mol
Flash Point: 245.8±22.9 °C
Index of Refraction: 1.528
Molar Refractivity: 98.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 4.79
ACD/LogD (pH 5.5): 5.19
ACD/BCF (pH 5.5): 5153.27
ACD/KOC (pH 5.5): 15801.61
ACD/LogD (pH 7.4): 5.19
ACD/BCF (pH 7.4): 5153.27
ACD/KOC (pH 7.4): 15801.61
Polar Surface Area: 47 Å2
Polarizability: 39.2±0.5 10-24cm3
Surface Tension: 42.1±3.0 dyne/cm
Molar Volume: 320.9±3.0 cm3

Click to predict properties on the Chemicalize site


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