ChemSpider 2D Image | 3-[(8Z,11Z)-8,11,14-Pentadecatrien-1-yl]-1,2-benzenediol | C21H30O2

3-[(8Z,11Z)-8,11,14-Pentadecatrien-1-yl]-1,2-benzenediol

  • Molecular FormulaC21H30O2
  • Average mass314.462 Da
  • Monoisotopic mass314.224579 Da
  • ChemSpider ID57509762

  • Double-bond stereo - Double-bond stereo

More details:

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

1,2-Benzenediol, 3-[(8Z,11Z)-8,11,14-pentadecatrien-1-yl]- [ACD/Index Name]
3-[(8Z,11Z)-8,11,14-Pentadecatrien-1-yl]-1,2-benzenediol [ACD/IUPAC Name]
3-[(8Z,11Z)-8,11,14-Pentadécatrién-1-yl]-1,2-benzènediol [French] [ACD/IUPAC Name]
3-[(8Z,11Z)-8,11,14-Pentadecatrien-1-yl]-1,2-benzoldiol [German] [ACD/IUPAC Name]
3-((8Z,11Z)-pentadeca-8,11,14-trien-1-yl)benzene-1,2-diol
3-((8Z,11Z)-pentadeca-8,11,14-trien-1-yl)catechol
3-(8Z,11Z,14-Pentadecatrienyl)-1,2-benzenediol
3-[(8Z,11Z)-PENTADECA-8,11,14-TRIEN-1-YL]BENZENE-1,2-DIOL
3-[(8Z,11Z)-pentadeca-8,11,14-trienyl]benzene-1,2-diol
83543-37-7 [RN]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 468.7±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.9±3.0 kJ/mol
Flash Point: 207.4±20.0 °C
Index of Refraction: 1.543
Molar Refractivity: 99.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 7.07
ACD/LogD (pH 5.5): 6.28
ACD/BCF (pH 5.5): 35057.33
ACD/KOC (pH 5.5): 62334.47
ACD/LogD (pH 7.4): 6.28
ACD/BCF (pH 7.4): 34881.21
ACD/KOC (pH 7.4): 62021.32
Polar Surface Area: 40 Å2
Polarizability: 39.5±0.5 10-24cm3
Surface Tension: 40.0±3.0 dyne/cm
Molar Volume: 316.0±3.0 cm3

Click to predict properties on the Chemicalize site


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