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Search term: ZSQLKDGBAFLLSE (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-[2-Hydroxy-4-(hydroxymethyl)phenyl]-6-methyl-2,6-heptanediol | C15H24O4

2-[2-Hydroxy-4-(hydroxymethyl)phenyl]-6-methyl-2,6-heptanediol

  • Molecular FormulaC15H24O4
  • Average mass268.349 Da
  • Monoisotopic mass268.167450 Da
  • ChemSpider ID78435146

More details:

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

1,4-Benzenedimethanol, 2-hydroxy-α1-(4-hydroxy-4-methylpentyl)-α1-methyl- [ACD/Index Name]
2-[2-Hydroxy-4-(hydroxymethyl)phenyl]-6-methyl-2,6-heptandiol [German] [ACD/IUPAC Name]
2-[2-Hydroxy-4-(hydroxymethyl)phenyl]-6-methyl-2,6-heptanediol [ACD/IUPAC Name]
2-[2-Hydroxy-4-(hydroxyméthyl)phényl]-6-méthyl-2,6-heptanediol [French] [ACD/IUPAC Name]
curcutetraol

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

Density: 1.2±0.1 g/cm3
Boiling Point: 443.4±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.9±3.0 kJ/mol
Flash Point: 207.7±20.0 °C
Index of Refraction: 1.563
Molar Refractivity: 74.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.10
ACD/LogD (pH 5.5): 0.88
ACD/BCF (pH 5.5): 2.77
ACD/KOC (pH 5.5): 72.19
ACD/LogD (pH 7.4): 0.88
ACD/BCF (pH 7.4): 2.77
ACD/KOC (pH 7.4): 72.12
Polar Surface Area: 81 Å2
Polarizability: 29.5±0.5 10-24cm3
Surface Tension: 50.5±3.0 dyne/cm
Molar Volume: 229.5±3.0 cm3

Click to predict properties on the Chemicalize site


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