ChemSpider 2D Image | 2-[3-(Ethoxycarbonyl)-1-piperidinyl]-5-nitrobenzoic acid | C15H18N2O6

2-[3-(Ethoxycarbonyl)-1-piperidinyl]-5-nitrobenzoic acid

  • Molecular FormulaC15H18N2O6
  • Average mass322.313 Da
  • Monoisotopic mass322.116486 Da
  • ChemSpider ID21328702

More details:

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

1000018-70-1 [RN]
2-[3-(Ethoxycarbonyl)-1-piperidinyl]-5-nitrobenzoesäure [German] [ACD/IUPAC Name]
2-[3-(Ethoxycarbonyl)-1-piperidinyl]-5-nitrobenzoic acid [ACD/IUPAC Name]
2-[3-(Ethoxycarbonyl)piperidin-1-yl]-5-nitrobenzoic acid
3-Ethyl 1-(2-carboxy-4-nitrophenyl)-3-piperidinecarboxylate
3-Piperidinecarboxylic acid, 1-(2-carboxy-4-nitrophenyl)-, 3-ethyl ester [ACD/Index Name]
Acide 2-[3-(éthoxycarbonyl)-1-pipéridinyl]-5-nitrobenzoïque [French] [ACD/IUPAC Name]
[1000018-70-1] [RN]
2-(3-(ethoxycarbonyl)piperidin-1-yl)-5-nitrobenzoic acid
2-(3-ethoxycarbonylpiperidin-1-yl)-5-nitrobenzoic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

MFCD09064901 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 506.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.8±3.0 kJ/mol
Flash Point: 260.2±30.1 °C
Index of Refraction: 1.582
Molar Refractivity: 80.1±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.10
ACD/LogD (pH 5.5): -0.18
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 113 Å2
Polarizability: 31.8±0.5 10-24cm3
Surface Tension: 57.7±3.0 dyne/cm
Molar Volume: 240.2±3.0 cm3

Click to predict properties on the Chemicalize site


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