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Search term: PQXAPANLBKXEKT (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (2E)-3-(3-Formylphenyl)acrylic acid | C10H8O3

(2E)-3-(3-Formylphenyl)acrylic acid

  • Molecular FormulaC10H8O3
  • Average mass176.169 Da
  • Monoisotopic mass176.047348 Da
  • ChemSpider ID62977557

More details:

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

(2E)-3-(3-Formylphenyl)acrylic acid [ACD/IUPAC Name]
(2E)-3-(3-Formylphenyl)acrylsäure [German] [ACD/IUPAC Name]
2-Propenoic acid, 3-(3-formylphenyl)-, (2E)- [ACD/Index Name]
Acide (2E)-3-(3-formylphényl)acrylique [French] [ACD/IUPAC Name]
56030-23-0 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 364.0±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.4±3.0 kJ/mol
Flash Point: 188.1±19.7 °C
Index of Refraction: 1.660
Molar Refractivity: 50.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.83
ACD/LogD (pH 5.5): 0.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.90
ACD/LogD (pH 7.4): -1.53
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 54 Å2
Polarizability: 20.0±0.5 10-24cm3
Surface Tension: 57.9±3.0 dyne/cm
Molar Volume: 136.7±3.0 cm3

Click to predict properties on the Chemicalize site


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