ChemSpider 2D Image | 4-[(3S)-3-Hydroxy-7-(4-hydroxyphenyl)heptyl]phenol | C19H24O3

4-[(3S)-3-Hydroxy-7-(4-hydroxyphenyl)heptyl]phenol

  • Molecular FormulaC19H24O3
  • Average mass300.392 Da
  • Monoisotopic mass300.172546 Da
  • ChemSpider ID82964325

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

4-[(3S)-3-Hydroxy-7-(4-hydroxyphenyl)heptyl]phenol [German] [ACD/IUPAC Name]
4-[(3S)-3-Hydroxy-7-(4-hydroxyphenyl)heptyl]phenol [ACD/IUPAC Name]
4-[(3S)-3-Hydroxy-7-(4-hydroxyphényl)heptyl]phénol [French] [ACD/IUPAC Name]
Benzenepentanol, 4-hydroxy-α-[2-(4-hydroxyphenyl)ethyl]-, (αS)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 524.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 84.0±3.0 kJ/mol
Flash Point: 244.6±23.3 °C
Index of Refraction: 1.597
Molar Refractivity: 88.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.74
ACD/LogD (pH 5.5): 3.73
ACD/BCF (pH 5.5): 401.68
ACD/KOC (pH 5.5): 2543.63
ACD/LogD (pH 7.4): 3.73
ACD/BCF (pH 7.4): 400.18
ACD/KOC (pH 7.4): 2534.18
Polar Surface Area: 61 Å2
Polarizability: 35.2±0.5 10-24cm3
Surface Tension: 52.1±3.0 dyne/cm
Molar Volume: 260.2±3.0 cm3

Click to predict properties on the Chemicalize site


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