ChemSpider 2D Image | 5-{(E)-2-[4-Hydroxy(~13~C_6_)phenyl]vinyl}-1,3-benzenediol | C813C6H12O3


  • Molecular FormulaC813C6H12O3
  • Average mass234.199 Da
  • Monoisotopic mass234.098770 Da
  • ChemSpider ID62850327
  • Non-standard isotope - Non-standard isotope

More details:

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

1,3-Benzenediol, 5-[(E)-2-(4-hydroxyphenyl-1,2,3,4,5,6-13C6)ethenyl]- [ACD/Index Name]
5-{(E)-2-[4-Hydroxy(13C6)phenyl]vinyl}-1,3-benzenediol [ACD/IUPAC Name]
5-{(E)-2-[4-Hydroxy(13C6)phényl]vinyl}-1,3-benzènediol [French] [ACD/IUPAC Name]
5-{(E)-2-[4-Hydroxy(13C6)phenyl]vinyl}-1,3-benzoldiol [German] [ACD/IUPAC Name]
1185247-70-4 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.763
Molar Refractivity: 69.3±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 27.5±0.5 10-24cm3
Surface Tension: 70.7±3.0 dyne/cm
Molar Volume: 167.9±3.0 cm3

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