ChemSpider 2D Image | 4-Hydroxy-3,5-bis[(~2~H_3_)methyloxy]benzoic acid | C9H4D6O5

4-Hydroxy-3,5-bis[(2H3)methyloxy]benzoic acid

  • Molecular FormulaC9H4D6O5
  • Average mass204.210 Da
  • Monoisotopic mass204.090485 Da
  • ChemSpider ID30773511

  • Non-standard isotope - Non-standard isotope

More details:

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

4-Hydroxy-3,5-bis[(2H3)methyloxy]benzoesäure [German] [ACD/IUPAC Name]
4-Hydroxy-3,5-bis[(2H3)methyloxy]benzoic acid [ACD/IUPAC Name]
Acide 4-hydroxy-3,5-bis[(2H3)méthyloxy]benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-hydroxy-3,5-bis(methyl-d3-oxy)- [ACD/Index Name]
3,5-Dimethoxy-d6-4-hydroxybenzoic acid
3,5-Dimethoxy-d6-4-hydroxybenzoic Acid
4-Hydroxy-3,5-dimethoxybenzoic acid [ACD/IUPAC Name]
84759-06-8 [RN]
Syringic acid

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

Density: 1.3±0.1 g/cm3
Boiling Point: 379.5±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 66.2±3.0 kJ/mol
Flash Point: 155.0±21.4 °C
Index of Refraction: 1.566
Molar Refractivity: 48.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.13
ACD/LogD (pH 5.5): -0.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.53
ACD/LogD (pH 7.4): -1.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 76 Å2
Polarizability: 19.2±0.5 10-24cm3
Surface Tension: 51.6±3.0 dyne/cm
Molar Volume: 148.4±3.0 cm3

Click to predict properties on the Chemicalize site


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