Found 1 result

Search term: InChI=1/C9H11NO3/c1-5(9(10)13)6-2-3-7(11)8(12)4-6/h2-5,11-12H,1H3,(H2,10,13)/f/h10H2 (Found by conversion of search term to chemical structure (tautomer/stereo mismatch))
ChemSpider 2D Image | 2-(3,4-Dihydroxyphenyl)propanamide | C9H11NO3

2-(3,4-Dihydroxyphenyl)propanamide

  • Molecular FormulaC9H11NO3
  • Average mass181.189 Da
  • Monoisotopic mass181.073898 Da
  • ChemSpider ID60615667

More details:

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

1132-22-5 [RN]
2-(3,4-Dihydroxyphenyl)propanamid [German] [ACD/IUPAC Name]
2-(3,4-Dihydroxyphenyl)propanamide [ACD/IUPAC Name]
2-(3,4-Dihydroxyphényl)propanamide [French] [ACD/IUPAC Name]
Benzeneacetamide, 3,4-dihydroxy-α-methyl- [ACD/Index Name]
MFCD20699419

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

Density: 1.3±0.1 g/cm3
Boiling Point: 451.1±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.7±3.0 kJ/mol
Flash Point: 226.6±25.9 °C
Index of Refraction: 1.613
Molar Refractivity: 47.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.54
ACD/LogD (pH 5.5): 0.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 27.18
ACD/LogD (pH 7.4): 0.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 26.84
Polar Surface Area: 84 Å2
Polarizability: 18.9±0.5 10-24cm3
Surface Tension: 63.0±3.0 dyne/cm
Molar Volume: 137.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement