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ChemSpider 2D Image | 4-Pentyl-1,1':2',1''-terphenyl-4'-carbonitrile | C24H23N


  • Molecular FormulaC24H23N
  • Average mass325.446 Da
  • Monoisotopic mass325.183044 Da
  • ChemSpider ID10756944

More details:

Date of deprecation: 18:16, Jul 15, 2013
Reason for deprecation: Deprecate record: Not supported by data sources.

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

[1,1':2',1''-Terphenyl]-4'-carbonitrile, 4-pentyl- [ACD/Index Name]
4-Pentyl-1,1':2',1''-terphenyl-4'-carbonitril [German] [ACD/IUPAC Name]
4-Pentyl-1,1':2',1''-terphenyl-4'-carbonitrile [ACD/IUPAC Name]
4-Pentyl-1,1':2',1''-terphényl-4'-carbonitrile [French] [ACD/IUPAC Name]
MFCD00799423 [MDL number]

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

Density: 1.1±0.0 g/cm3
Boiling Point: 454.8±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 71.4±0.0 kJ/mol
Flash Point: 230.5±0.0 °C
Index of Refraction: 1.609
Molar Refractivity: 103.9±0.0 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 7.82
ACD/LogD (pH 5.5): 7.82
ACD/BCF (pH 5.5): 514050.38
ACD/KOC (pH 5.5): 426097.97
ACD/LogD (pH 7.4): 7.82
ACD/BCF (pH 7.4): 514050.38
ACD/KOC (pH 7.4): 426097.97
Polar Surface Area: 24 Å2
Polarizability: 41.2±0.0 10-24cm3
Surface Tension: 49.4±0.0 dyne/cm
Molar Volume: 300.2±0.0 cm3

Click to predict properties on the Chemicalize site

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