ChemSpider 2D Image | (2E)-3-{4-Hydroxy-3-[(~2~H_3_)methyloxy]phenyl}acrylic acid | C10H7D3O4

(2E)-3-{4-Hydroxy-3-[(2H3)methyloxy]phenyl}acrylic acid

  • Molecular FormulaC10H7D3O4
  • Average mass197.202 Da
  • Monoisotopic mass197.076736 Da
  • ChemSpider ID23936140
  • Double-bond stereo - Double-bond stereo

    Non-standard isotope - Non-standard isotope


More details:






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

(2E)-3-{4-Hydroxy-3-[(2H3)methyloxy]phenyl}acrylic acid [ACD/IUPAC Name]
(2E)-3-{4-Hydroxy-3-[(2H3)methyloxy]phenyl}acrylsäure [German] [ACD/IUPAC Name]
2-Propenoic acid, 3-[4-hydroxy-3-(methyl-d3-oxy)phenyl]-, (2E)- [ACD/Index Name]
Acide (2E)-3-{4-hydroxy-3-[(2H3)méthyloxy]phényl}acrylique [French] [ACD/IUPAC Name]
(E)-3-[4-hydroxy-3-(trideuteriomethoxy)phenyl]prop-2-enoic acid
3-Methoxy-d3-4-hydrocinnamic Acid
4-HYDROXY-3-METHOXY-D3-CINNAMIC ACID
860605-59-0 [RN]
Ferulic acid [Wiki]
Ferulic acid-d3
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 372.3±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.3±3.0 kJ/mol
Flash Point: 150.5±17.2 °C
Index of Refraction: 1.627
Molar Refractivity: 52.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.64
ACD/LogD (pH 5.5): 0.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 10.25
ACD/LogD (pH 7.4): -1.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 67 Å2
Polarizability: 20.7±0.5 10-24cm3
Surface Tension: 56.2±3.0 dyne/cm
Molar Volume: 147.5±3.0 cm3

Click to predict properties on the Chemicalize site






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