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ChemSpider 2D Image | diazabicyclooctane | C14H28N2

diazabicyclooctane

  • Molecular FormulaC14H28N2
  • Average mass224.385 Da
  • Monoisotopic mass224.225250 Da
  • ChemSpider ID24770590

More details:

Date of deprecation: 15:35, Dec 2, 2015
Reason for deprecation: Deprecate record: appears to be an example of a text-mining / name-to-structure conversion error

If you believe this record was deprecated in error, please use the Comment on this record button to contact the ChemSpider team.

Common reasons for deprecation are:
  • Chemically impossible structures (eg. incorrect valence atoms)
  • Lack of any linking data sources
  • Poor depiction of a structure that is already in ChemSpider

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

1,2-Diazocine, 1-cyclooctyloctahydro- [ACD/Index Name]
1-Cyclooctyl-1,2-diazocan [German] [ACD/IUPAC Name]
1-Cyclooctyl-1,2-diazocane [ACD/IUPAC Name]
1-Cyclooctyl-1,2-diazocane [French] [ACD/IUPAC Name]
diazabicyclooctane
diazabicyclo-octane

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

Density: 0.9±0.1 g/cm3
Boiling Point: 326.7±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.9±3.0 kJ/mol
Flash Point: 150.2±17.8 °C
Index of Refraction: 1.480
Molar Refractivity: 69.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.92
ACD/LogD (pH 5.5): 1.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.87
ACD/LogD (pH 7.4): 2.37
ACD/BCF (pH 7.4): 15.22
ACD/KOC (pH 7.4): 84.49
Polar Surface Area: 15 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 32.6±3.0 dyne/cm
Molar Volume: 244.6±3.0 cm3

Click to predict properties on the Chemicalize site


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