ChemSpider 2D Image | 4-[(~2~H_7_)-2-Propanyl](~2~H_4_)aniline | C9H2D11N

4-[(2H7)-2-Propanyl](2H4)aniline

  • Molecular FormulaC9H2D11N
  • Average mass146.274 Da
  • Monoisotopic mass146.173843 Da
  • ChemSpider ID60597137
  • Non-standard isotope - Non-standard isotope


More details:






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

4-[(2H7)-2-Propanyl](2H4)anilin [German] [ACD/IUPAC Name]
4-[(2H7)-2-Propanyl](2H4)aniline [ACD/IUPAC Name]
4-[(2H7)-2-Propanyl](2H4)aniline [French] [ACD/IUPAC Name]
Benzen-2,3,5,6-d4-amine, 4-[1-(methyl-d3)ethyl-1,2,2,2-d4]- [ACD/Index Name]
cumidine

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

Density: 1.0±0.1 g/cm3
Boiling Point: 225.6±9.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 46.2±3.0 kJ/mol
Flash Point: 92.2±0.0 °C
Index of Refraction: 1.543
Molar Refractivity: 44.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.28
ACD/LogD (pH 5.5): 2.12
ACD/BCF (pH 5.5): 22.42
ACD/KOC (pH 5.5): 297.90
ACD/LogD (pH 7.4): 2.24
ACD/BCF (pH 7.4): 29.47
ACD/KOC (pH 7.4): 391.63
Polar Surface Area: 26 Å2
Polarizability: 17.7±0.5 10-24cm3
Surface Tension: 36.4±3.0 dyne/cm
Molar Volume: 141.8±3.0 cm3

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