ChemSpider 2D Image | (2S,4S)-2,4-Piperidinedicarboxylic acid | C7H11NO4

(2S,4S)-2,4-Piperidinedicarboxylic acid

  • Molecular FormulaC7H11NO4
  • Average mass173.167 Da
  • Monoisotopic mass173.068802 Da
  • ChemSpider ID23126187

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S,4S)-2,4-Piperidindicarbonsäure [German] [ACD/IUPAC Name]
(2S,4S)-2,4-Piperidinedicarboxylic acid [ACD/IUPAC Name]
(2S,4S)-piperidine-2,4-dicarboxylic acid
2,4-Piperidinedicarboxylic acid, (2S,4S)- [ACD/Index Name]
Acide (2S,4S)-2,4-pipéridinedicarboxylique [French] [ACD/IUPAC Name]
Piperidine-2,4-dicarboxylic acid (PDA)

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

Density: 1.4±0.1 g/cm3
Boiling Point: 362.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 66.8±6.0 kJ/mol
Flash Point: 172.9±27.9 °C
Index of Refraction: 1.520
Molar Refractivity: 38.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.72
ACD/LogD (pH 5.5): -3.97
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 87 Å2
Polarizability: 15.3±0.5 10-24cm3
Surface Tension: 57.3±3.0 dyne/cm
Molar Volume: 127.0±3.0 cm3

Click to predict properties on the Chemicalize site


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