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ChemSpider 2D Image | {1,4-Phenylenebis[methylylidene(7,7-dimethyl-2-oxobicyclo[2.2.1]hept-1-yl-3-ylidene)]}dimethanesulfonic acid | C28H34O8S2

{1,4-Phenylenebis[methylylidene(7,7-dimethyl-2-oxobicyclo[2.2.1]hept-1-yl-3-ylidene)]}dimethanesulfonic acid

  • Molecular FormulaC28H34O8S2
  • Average mass562.695 Da
  • Monoisotopic mass562.169495 Da
  • ChemSpider ID28534218

More details:

Date of deprecation: 10:11, Aug 26, 2015
Reason for deprecation: Deprecate record: there are no supporting 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

{1,4-Phenylenbis[methylyliden(7,7-dimethyl-2-oxobicyclo[2.2.1]hept-1-yl-3-yliden)]}dimethansulfonsäure [German] [ACD/IUPAC Name]
{1,4-Phenylenebis[methylylidene(7,7-dimethyl-2-oxobicyclo[2.2.1]hept-1-yl-3-ylidene)]}dimethanesulfonic acid [ACD/IUPAC Name]
Acide {1,4-phénylènebis[méthylylidène(7,7-diméthyl-2-oxobicyclo[2.2.1]hept-1-yl-3-ylidène)]}diméthanesulfonique [French] [ACD/IUPAC Name]
Bicyclo[2.2.1]heptane-1-methanesulfonic acid, 3,3'-(1,4-phenylenedimethylidyne)bis[7,7-dimethyl-2-oxo- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.631
Molar Refractivity: 140.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 1.35
ACD/LogD (pH 5.5): -4.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 160 Å2
Polarizability: 55.8±0.5 10-24cm3
Surface Tension: 64.1±3.0 dyne/cm
Molar Volume: 395.1±3.0 cm3

Click to predict properties on the Chemicalize site


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