ChemSpider 2D Image | MIBK-13C6 | 13C6H12O


  • Molecular Formula13C6H12O
  • Average mass106.115 Da
  • Monoisotopic mass106.108948 Da
  • ChemSpider ID48244841
  • Non-standard isotope - Non-standard isotope

More details:

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

2-Pentanone-1,2,3,4,5-13C5, 4-(methyl-13C)- [ACD/Index Name]
4-(13C)Methyl-2-(13C5)pentanon [German] [ACD/IUPAC Name]
4-(13C)Methyl-2-(13C5)pentanone [ACD/IUPAC Name]
4-(13C)Méthyl-2-(13C5)pentanone [French] [ACD/IUPAC Name]
Isobutyl methyl ketone-13C6
Methyl isobutyl ketone-13C6

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

Density: 0.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.393
Molar Refractivity: 29.8±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: 11.8±0.5 10-24cm3
Surface Tension: 22.8±3.0 dyne/cm
Molar Volume: 125.1±3.0 cm3

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