ChemSpider 2D Image | MFCD16652565 | C213C6H8O3


  • Molecular FormulaC213C6H8O3
  • Average mass158.103 Da
  • Monoisotopic mass158.067474 Da
  • ChemSpider ID48060153
  • Non-standard isotope - Non-standard isotope

More details:

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

1581694-95-2 [RN]
4-Hydroxy(13C6)benzoate de méthyle [French] [ACD/IUPAC Name]
4-Hydroxybenzoic acid-(ring-13C6) methyl ester
Benzoic-1,2,3,4,5,6-13C6 acid, 4-hydroxy-, methyl ester [ACD/Index Name]
Methyl 4-hydroxy(13C6)benzoate [ACD/IUPAC Name]
Methyl 4-hydroxybenzoate-(ring-13C6)
Methyl paraben-(ring-13C6)
Methyl-4-hydroxy(13C6)benzoat [German] [ACD/IUPAC Name]
Methyl 4-hydroxy(13C6)benzoate

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.547
Molar Refractivity: 39.9±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: 15.8±0.5 10-24cm3
Surface Tension: 45.8±3.0 dyne/cm
Molar Volume: 125.8±3.0 cm3

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