ChemSpider 2D Image | pC-HSL | C13H13NO4

pC-HSL

  • Molecular FormulaC13H13NO4
  • Average mass247.247 Da
  • Monoisotopic mass247.084457 Da
  • ChemSpider ID30790745

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2E)-3-(4-Hydroxyphenyl)-N-[(3S)-2-oxotetrahydro-3-furanyl]acrylamid [German] [ACD/IUPAC Name]
(2E)-3-(4-Hydroxyphenyl)-N-[(3S)-2-oxotetrahydro-3-furanyl]acrylamide [ACD/IUPAC Name]
(2E)-3-(4-Hydroxyphényl)-N-[(3S)-2-oxotétrahydro-3-furanyl]acrylamide [French] [ACD/IUPAC Name]
2-Propenamide, 3-(4-hydroxyphenyl)-N-[(3S)-tetrahydro-2-oxo-3-furanyl]-, (2E)- [ACD/Index Name]
MFCD12912377
N-(4-coumaroyl)-L-homoserine lactone
N-(p-coumaroyl)-L-homoserine lactone
pC-HSL
p-Coumaroyl (S)-(-)α-amino-γ-butyrolactone
(2E)-3-(4-HYDROXYPHENYL)-N-[(3S)-2-OXOOXOLAN-3-YL]PROP-2-ENAMIDE
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 591.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.5±3.0 kJ/mol
Flash Point: 311.5±30.1 °C
Index of Refraction: 1.609
Molar Refractivity: 64.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.20
ACD/LogD (pH 5.5): 0.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 32.06
ACD/LogD (pH 7.4): 0.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 31.89
Polar Surface Area: 76 Å2
Polarizability: 25.4±0.5 10-24cm3
Surface Tension: 59.3±5.0 dyne/cm
Molar Volume: 185.3±5.0 cm3

Click to predict properties on the Chemicalize site


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