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Search term: SPTIETJWCCCJSE (Found by InChIKey (skeleton match))
ChemSpider 2D Image | Nitracaine | C16H24N2O4

Nitracaine

  • Molecular FormulaC16H24N2O4
  • Average mass308.373 Da
  • Monoisotopic mass308.173615 Da
  • ChemSpider ID29341792

More details:

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

1648893-21-3 [RN]
1-Propanol, 3-(diethylamino)-2,2-dimethyl-, 4-nitrobenzoate (ester) [ACD/Index Name]
3-(Diethylamino)-2,2-dimethylpropyl 4-nitrobenzoate [ACD/IUPAC Name]
3-(Diethylamino)-2,2-dimethylpropyl-4-nitrobenzoat [German] [ACD/IUPAC Name]
4-Nitrobenzoate de 3-(diéthylamino)-2,2-diméthylpropyle [French] [ACD/IUPAC Name]
B8ZB08WI9O
Nitracaine [Wiki]
[3-(diethylamino)-2,2-dimethylpropyl] 4-nitrobenzoate
UNII:B8ZB08WI9O

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

Density: 1.1±0.1 g/cm3
Boiling Point: 414.4±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.7±3.0 kJ/mol
Flash Point: 204.4±24.6 °C
Index of Refraction: 1.525
Molar Refractivity: 85.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.93
ACD/LogD (pH 5.5): 0.89
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.85
ACD/LogD (pH 7.4): 1.47
ACD/BCF (pH 7.4): 1.92
ACD/KOC (pH 7.4): 10.74
Polar Surface Area: 75 Å2
Polarizability: 33.8±0.5 10-24cm3
Surface Tension: 41.4±3.0 dyne/cm
Molar Volume: 278.5±3.0 cm3

Click to predict properties on the Chemicalize site


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