ChemSpider 2D Image | MFCD04118204 | C613CH8


  • Molecular FormulaC613CH8
  • Average mass93.131 Da
  • Monoisotopic mass93.065956 Da
  • ChemSpider ID49071421
  • Non-standard isotope - Non-standard isotope

More details:

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

78218-02-7 [RN]
Benzene-13C, 4-methyl- [ACD/Index Name]
Methyl(4-13C)benzene [ACD/IUPAC Name]
Méthyl(4-13C)benzène [French] [ACD/IUPAC Name]
Methyl(4-13C)benzol [German] [ACD/IUPAC Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.500
Molar Refractivity: 31.1±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: 12.3±0.5 10-24cm3
Surface Tension: 28.8±3.0 dyne/cm
Molar Volume: 105.7±3.0 cm3

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