ChemSpider 2D Image | 4,4'-[(3R)-1,4-Pentadiene-1,3-diyl]diphenol | C17H16O2

4,4'-[(3R)-1,4-Pentadiene-1,3-diyl]diphenol

  • Molecular FormulaC17H16O2
  • Average mass252.308 Da
  • Monoisotopic mass252.115036 Da
  • ChemSpider ID58107492

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

4,4'-[(3R)-1,4-Pentadien-1,3-diyl]diphenol [German] [ACD/IUPAC Name]
4,4'-[(3R)-1,4-Pentadiene-1,3-diyl]diphenol [ACD/IUPAC Name]
4,4'-[(3R)-1,4-Pentadiène-1,3-diyl]diphénol [French] [ACD/IUPAC Name]
Phenol, 4,4'-[(3R)-3-ethenyl-1-propene-1,3-diyl]bis- [ACD/Index Name]
4-[(3R)-3-(4-Hydroxyphenyl)penta-1,4-dienyl]phenol
96895-25-9 [RN]
Phenol, 4,4'-[(1Z,3R)-3-ethenyl-1-propene-1,3-diyl]bis- [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: 429.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.1±3.0 kJ/mol
Flash Point: 203.8±21.9 °C
Index of Refraction: 1.653
Molar Refractivity: 79.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.71
ACD/LogD (pH 5.5): 3.46
ACD/BCF (pH 5.5): 252.91
ACD/KOC (pH 5.5): 1826.59
ACD/LogD (pH 7.4): 3.46
ACD/BCF (pH 7.4): 251.46
ACD/KOC (pH 7.4): 1816.14
Polar Surface Area: 40 Å2
Polarizability: 31.5±0.5 10-24cm3
Surface Tension: 51.1±3.0 dyne/cm
Molar Volume: 216.8±3.0 cm3

Click to predict properties on the Chemicalize site


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