ChemSpider 2D Image | Ketorolac | C15H8D5NO3

Ketorolac

  • Molecular FormulaC15H8D5NO3
  • Average mass260.299 Da
  • Monoisotopic mass260.120941 Da
  • ChemSpider ID24022485

  • Non-standard isotope - Non-standard isotope

More details:

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

1215767-66-0 [RN]
1H-Pyrrolizine-1-carboxylic acid, 2,3-dihydro-5-(phenyl-d5-carbonyl)- [ACD/Index Name]
5-[(2H5)Phenylcarbonyl]-2,3-dihydro-1H-pyrrolizin-1-carbonsäure [German] [ACD/IUPAC Name]
5-[(2H5)Phenylcarbonyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid [ACD/IUPAC Name]
74103-06-3 [RN]
Acide 5-[(2H5)phénylcarbonyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylique [French] [ACD/IUPAC Name]
Ketorolac [INN] [Wiki]
KETOROLAC-D5
5-(2,3,4,5,6-pentadeuteriobenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid
Ketorolac D5

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

Density: 1.3±0.1 g/cm3
Boiling Point: 493.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 80.1±3.0 kJ/mol
Flash Point: 252.1±27.3 °C
Index of Refraction: 1.659
Molar Refractivity: 70.5±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.08
ACD/LogD (pH 5.5): 1.34
ACD/BCF (pH 5.5): 3.12
ACD/KOC (pH 5.5): 34.99
ACD/LogD (pH 7.4): -0.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 59 Å2
Polarizability: 28.0±0.5 10-24cm3
Surface Tension: 54.8±7.0 dyne/cm
Molar Volume: 191.2±7.0 cm3

Click to predict properties on the Chemicalize site


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