ChemSpider 2D Image | (2S,4S)-5-Isopropyl-4-(4-methoxyphenyl)-8-methyl-2-phenylchromane | C26H28O2

(2S,4S)-5-Isopropyl-4-(4-methoxyphenyl)-8-methyl-2-phenylchromane

  • Molecular FormulaC26H28O2
  • Average mass372.499 Da
  • Monoisotopic mass372.208923 Da
  • ChemSpider ID25025262

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S,4S)-5-Isopropyl-4-(4-methoxyphenyl)-8-methyl-2-phenylchroman [German] [ACD/IUPAC Name]
(2S,4S)-5-Isopropyl-4-(4-methoxyphenyl)-8-methyl-2-phenylchromane [ACD/IUPAC Name]
(2S,4S)-5-Isopropyl-4-(4-méthoxyphényl)-8-méthyl-2-phénylchromane [French] [ACD/IUPAC Name]
2H-1-Benzopyran, 3,4-dihydro-4-(4-methoxyphenyl)-8-methyl-5-(1-methylethyl)-2-phenyl-, (2S,4S)- [ACD/Index Name]
(2S,4S)-5-isopropyl-4-(4-methoxyphenyl)-8-methyl-2-phenyl-chroman

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

Density: 1.1±0.1 g/cm3
Boiling Point: 485.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 72.3±3.0 kJ/mol
Flash Point: 168.1±28.3 °C
Index of Refraction: 1.577
Molar Refractivity: 114.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 7.48
ACD/LogD (pH 5.5): 6.80
ACD/BCF (pH 5.5): 87361.57
ACD/KOC (pH 5.5): 119833.04
ACD/LogD (pH 7.4): 6.80
ACD/BCF (pH 7.4): 87361.57
ACD/KOC (pH 7.4): 119833.04
Polar Surface Area: 18 Å2
Polarizability: 45.4±0.5 10-24cm3
Surface Tension: 40.7±3.0 dyne/cm
Molar Volume: 346.0±3.0 cm3

Click to predict properties on the Chemicalize site


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