ChemSpider 2D Image | 8-ISOPROPYL-3-NORTROPANONE | C10H17NO

8-ISOPROPYL-3-NORTROPANONE

  • Molecular FormulaC10H17NO
  • Average mass167.248 Da
  • Monoisotopic mass167.131012 Da
  • ChemSpider ID32798023

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1R,5S)-8-Isopropyl-8-azabicyclo[3.2.1]octan-3-on [German] [ACD/IUPAC Name]
(1R,5S)-8-Isopropyl-8-azabicyclo[3.2.1]octan-3-one [ACD/IUPAC Name]
(1R,5S)-8-Isopropyl-8-azabicyclo[3.2.1]octan-3-one [French] [ACD/IUPAC Name]
222-315-4 [EINECS]
3423-28-7 [RN]
8-Azabicyclo[3.2.1]octan-3-one, 8-(1-methylethyl)-, (1R,5S)- [ACD/Index Name]
8-ISOPROPYL-3-NORTROPANONE
8-(propan-2-yl)-8-azabicyclo[3.2.1]octan-3-one
95%

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

2AX5JUG49K [DBID]
UNII:2AX5JUG49K [DBID]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 254.7±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.2±3.0 kJ/mol
Flash Point: 100.5±10.0 °C
Index of Refraction: 1.501
Molar Refractivity: 47.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.95
ACD/LogD (pH 5.5): -2.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.51
Polar Surface Area: 20 Å2
Polarizability: 19.0±0.5 10-24cm3
Surface Tension: 35.5±3.0 dyne/cm
Molar Volume: 162.6±3.0 cm3

Click to predict properties on the Chemicalize site


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