ChemSpider 2D Image | 4,4'-[(1R,2R,3S,4S)-3,4-Dimethyl-1,2-cyclobutanediyl]bis(2-methoxyphenol) | C20H24O4

4,4'-[(1R,2R,3S,4S)-3,4-Dimethyl-1,2-cyclobutanediyl]bis(2-methoxyphenol)

  • Molecular FormulaC20H24O4
  • Average mass328.402 Da
  • Monoisotopic mass328.167450 Da
  • ChemSpider ID23286937

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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4,4'-[(1R,2R,3S,4S)-3,4-Dimethyl-1,2-cyclobutandiyl]bis(2-methoxyphenol) [German] [ACD/IUPAC Name]
4,4'-[(1R,2R,3S,4S)-3,4-Dimethyl-1,2-cyclobutanediyl]bis(2-methoxyphenol) [ACD/IUPAC Name]
4,4'-[(1R,2R,3S,4S)-3,4-Diméthyl-1,2-cyclobutanediyl]bis(2-méthoxyphénol) [French] [ACD/IUPAC Name]
4,4'-[(1R,2R,3S,4S)-3,4-dimethylcyclobutane-1,2-diyl]bis(2-methoxyphenol)
Phenol, 4,4'-[(1R,2R,3S,4S)-3,4-dimethyl-1,2-cyclobutanediyl]bis[2-methoxy- [ACD/Index Name]
8-β,8'-α-dimethyl-7-α,7'-β-bis(3-methoxy-4-hydroxy-phenyl)cyclobutane
CHEMBL228274
ENDIANDRIN A

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

Density: 1.2±0.1 g/cm3
Boiling Point: 467.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.7±3.0 kJ/mol
Flash Point: 236.5±28.7 °C
Index of Refraction: 1.575
Molar Refractivity: 93.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.06
ACD/LogD (pH 5.5): 4.11
ACD/BCF (pH 5.5): 779.10
ACD/KOC (pH 5.5): 4086.94
ACD/LogD (pH 7.4): 4.11
ACD/BCF (pH 7.4): 776.95
ACD/KOC (pH 7.4): 4075.65
Polar Surface Area: 59 Å2
Polarizability: 37.2±0.5 10-24cm3
Surface Tension: 43.3±3.0 dyne/cm
Molar Volume: 284.2±3.0 cm3

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