ChemSpider 2D Image | 2,4-Dihydroxy-3,5,6-trimethylbenzoate | C10H11O4

2,4-Dihydroxy-3,5,6-trimethylbenzoate

  • Molecular FormulaC10H11O4
  • Average mass195.193 Da
  • Monoisotopic mass195.066284 Da
  • ChemSpider ID58170191

  • Charge - Charge

More details:

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

2,4-Dihydroxy-3,5,6-trimethylbenzoat [German] [ACD/IUPAC Name]
2,4-Dihydroxy-3,5,6-trimethylbenzoate [ACD/IUPAC Name]
2,4-Dihydroxy-3,5,6-triméthylbenzoate [French] [ACD/IUPAC Name]
Benzoic acid, 2,4-dihydroxy-3,5,6-trimethyl-, ion(1-) [ACD/Index Name]
3,5-dimethylorsellinate
  • Miscellaneous

    • Chemical Class:

      A dihydroxybenzoate that is the conjugate base of 3,5-dimethylorsellinic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. ChEBI CHEBI:131856

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

Density:
Boiling Point: 407.8±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.6±3.0 kJ/mol
Flash Point: 214.6±23.8 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.98
ACD/LogD (pH 5.5): -0.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.34
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 81 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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