ChemSpider 2D Image | 1-(7-Oxo-4,5,6,7-tetrahydro-1-benzothiophen-4-yl)(~13~C,~15~N_2_)urea | C813CH1015N2O2S


  • Molecular FormulaC813CH1015N2O2S
  • Average mass213.232 Da
  • Monoisotopic mass213.043716 Da
  • ChemSpider ID107439562
  • Non-standard isotope - Non-standard isotope

More details:

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

1-(7-Oxo-4,5,6,7-tetrahydro-1-benzothiophen-4-yl)(13C,15N2)harnstoff [German] [ACD/IUPAC Name]
1-(7-Oxo-4,5,6,7-tetrahydro-1-benzothiophen-4-yl)(13C,15N2)urea [ACD/IUPAC Name]
1-(7-Oxo-4,5,6,7-tétrahydro-1-benzothiophén-4-yl)(13C,15N2)urée [French] [ACD/IUPAC Name]
Urea-13C-15N2, N-(4,5,6,7-tetrahydro-7-oxobenzo[b]thien-4-yl)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.635
Molar Refractivity: 53.5±0.4 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: 21.2±0.5 10-24cm3
Surface Tension: 64.7±5.0 dyne/cm
Molar Volume: 149.4±5.0 cm3

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