ChemSpider 2D Image | (3S,6E)-1,7-Diphenyl-6-hepten-3-ol | C19H22O

(3S,6E)-1,7-Diphenyl-6-hepten-3-ol

  • Molecular FormulaC19H22O
  • Average mass266.377 Da
  • Monoisotopic mass266.167053 Da
  • ChemSpider ID23329047

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S,6E)-1,7-Diphenyl-6-hepten-3-ol [German] [ACD/IUPAC Name]
(3S,6E)-1,7-Diphenyl-6-hepten-3-ol [ACD/IUPAC Name]
(3S,6E)-1,7-Diphényl-6-heptén-3-ol [French] [ACD/IUPAC Name]
Benzenepropanol, α-[(3E)-4-phenyl-3-buten-1-yl]-, (αS)- [ACD/Index Name]
(3S,6E)-1,7-diphenylhept-6-en-3-ol
(S)-1,7-diphenylhept-6-en-3-ol
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL461017/

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

Density: 1.0±0.1 g/cm3
Boiling Point: 440.1±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.5±3.0 kJ/mol
Flash Point: 173.9±21.4 °C
Index of Refraction: 1.595
Molar Refractivity: 86.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.82
ACD/LogD (pH 5.5): 4.42
ACD/BCF (pH 5.5): 1345.54
ACD/KOC (pH 5.5): 6043.14
ACD/LogD (pH 7.4): 4.42
ACD/BCF (pH 7.4): 1345.54
ACD/KOC (pH 7.4): 6043.14
Polar Surface Area: 20 Å2
Polarizability: 34.4±0.5 10-24cm3
Surface Tension: 43.7±3.0 dyne/cm
Molar Volume: 255.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement