Deprecated ChemSpider Record

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ChemSpider 2D Image | Sodium (5E,9Z)-6-bromo-21-methyl-5,9-docosadienoate | C23H40BrNaO2

Sodium (5E,9Z)-6-bromo-21-methyl-5,9-docosadienoate

  • Molecular FormulaC23H40BrNaO2
  • Average mass451.456 Da
  • Monoisotopic mass450.210938 Da
  • ChemSpider ID10480981

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

More details:

Date of deprecation: 13:53, Dec 22, 2015
Reason for deprecation: Deprecate record: covalent - O-Na bond

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

(5E,9Z)-6-Bromo-21-méthyl-5,9-docosadiénoate de sodium [French] [ACD/IUPAC Name]
5,9-Docosadienoic acid, 6-bromo-21-methyl-, sodium salt, (5E,9Z)- (1:1) [ACD/Index Name]
Natrium-(5E,9Z)-6-brom-21-methyl-5,9-docosadienoat [German] [ACD/IUPAC Name]
Sodium (5E,9Z)-6-bromo-21-methyl-5,9-docosadienoate [ACD/IUPAC Name]
microcionin-1

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 20
#Rule of 5 Violations:
ACD/LogP:
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: 26 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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