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Search term: 30771147 (Found by CSID)
ChemSpider 2D Image | (2S)-1-[4-Hydroxy-2-(3-hydroxy-5-methylphenoxy)-6-methylphenyl]-3-methyl-2,3-butanediol | C19H24O5

(2S)-1-[4-Hydroxy-2-(3-hydroxy-5-methylphenoxy)-6-methylphenyl]-3-methyl-2,3-butanediol

  • Molecular FormulaC19H24O5
  • Average mass332.391 Da
  • Monoisotopic mass332.162384 Da
  • ChemSpider ID30771147

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-1-[4-Hydroxy-2-(3-hydroxy-5-methylphenoxy)-6-methylphenyl]-3-methyl-2,3-butandiol [German] [ACD/IUPAC Name]
(2S)-1-[4-Hydroxy-2-(3-hydroxy-5-methylphenoxy)-6-methylphenyl]-3-methyl-2,3-butanediol [ACD/IUPAC Name]
(2S)-1-[4-Hydroxy-2-(3-hydroxy-5-méthylphénoxy)-6-méthylphényl]-3-méthyl-2,3-butanediol [French] [ACD/IUPAC Name]
2,3-Butanediol, 1-[4-hydroxy-2-(3-hydroxy-5-methylphenoxy)-6-methylphenyl]-3-methyl-, (2S)- [ACD/Index Name]
diorcinol B

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

Density: 1.2±0.1 g/cm3
Boiling Point: 554.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.9±3.0 kJ/mol
Flash Point: 289.3±30.1 °C
Index of Refraction: 1.609
Molar Refractivity: 92.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.84
ACD/LogD (pH 5.5): 2.76
ACD/BCF (pH 5.5): 74.26
ACD/KOC (pH 5.5): 759.79
ACD/LogD (pH 7.4): 2.76
ACD/BCF (pH 7.4): 73.35
ACD/KOC (pH 7.4): 750.42
Polar Surface Area: 90 Å2
Polarizability: 36.7±0.5 10-24cm3
Surface Tension: 54.4±3.0 dyne/cm
Molar Volume: 267.2±3.0 cm3

Click to predict properties on the Chemicalize site


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