Deprecated ChemSpider Record

You have reached the page for a ChemSpider record that has been deprecated.

This page is not active and is only accessible by directly using this URL. If you have been directed here from another website or database please notify the administrator of that resource. See below for more details.

ChemSpider 2D Image | Hexanedioic acid - 1,4-butanediol (1:1) | C10H20O6

Hexanedioic acid - 1,4-butanediol (1:1)

  • Molecular FormulaC10H20O6
  • Average mass236.262 Da
  • Monoisotopic mass236.125992 Da
  • ChemSpider ID30395

More details:

Date of deprecation: 16:03, Sep 2, 2013
Reason for deprecation: Deprecate record: erroneous attempt at describing a polymer using it's monomers

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

Acide hexanedioïque - 1,4-butanediol (1:1) [French] [ACD/IUPAC Name]
Hexandisäure --1,4-butandiol (1:1) [German] [ACD/IUPAC Name]
Hexanedioic acid - 1,4-butanediol (1:1) [ACD/IUPAC Name]
Hexanedioic acid, compd. with 1,4-butanediol (1:1) [ACD/Index Name]
butane-1,4-diol;hexanedioic acid
Hexanedioic acid, polymer with 1,4-butanediol

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

181501_ALDRICH [DBID]
458341_ALDRICH [DBID]

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

Density:
Boiling Point: 338.5±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 64.0±0.0 kJ/mol
Flash Point: 172.7±0.0 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.08
ACD/LogD (pH 5.5): -1.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.54
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 53 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


Advertisement