ChemSpider 2D Image | (4S)-2,2'-(2,2-Propanediyl)bis(4-phenyl-4,5-dihydro-1,3-oxazole) | C21H22N2O2

(4S)-2,2'-(2,2-Propanediyl)bis(4-phenyl-4,5-dihydro-1,3-oxazole)

  • Molecular FormulaC21H22N2O2
  • Average mass334.412 Da
  • Monoisotopic mass334.168121 Da
  • ChemSpider ID29316888

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(4S)-2,2'-(2,2-Propandiyl)bis(4-phenyl-4,5-dihydro-1,3-oxazol) [German] [ACD/IUPAC Name]
(4S)-2,2'-(2,2-Propanediyl)bis(4-phenyl-4,5-dihydro-1,3-oxazole) [ACD/IUPAC Name]
(4S)-2,2'-(2,2-Propanediyl)bis(4-phényl-4,5-dihydro-1,3-oxazole) [French] [ACD/IUPAC Name]
Oxazole, 2,2'-(1-methylethylidene)bis[4,5-dihydro-4-phenyl-, (4S)- [ACD/Index Name]
(S)(-)-2,2'-Isopropylidene-bis(4-phenyl-2-oxazoline)
131457-46-0 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 468.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.3±3.0 kJ/mol
Flash Point: 190.5±21.2 °C
Index of Refraction: 1.612
Molar Refractivity: 98.2±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.45
ACD/LogD (pH 5.5): 3.09
ACD/BCF (pH 5.5): 124.39
ACD/KOC (pH 5.5): 1038.72
ACD/LogD (pH 7.4): 3.17
ACD/BCF (pH 7.4): 151.34
ACD/KOC (pH 7.4): 1263.78
Polar Surface Area: 43 Å2
Polarizability: 38.9±0.5 10-24cm3
Surface Tension: 43.0±7.0 dyne/cm
Molar Volume: 282.6±7.0 cm3

Click to predict properties on the Chemicalize site


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