ChemSpider 2D Image | (3R,5S)-3,5-Piperidinedicarboxylic acid | C7H11NO4

(3R,5S)-3,5-Piperidinedicarboxylic acid

  • Molecular FormulaC7H11NO4
  • Average mass173.167 Da
  • Monoisotopic mass173.068802 Da
  • ChemSpider ID23345866
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

(3R,5S)-3,5-Piperidindicarbonsäure [German] [ACD/IUPAC Name]
(3R,5S)-3,5-Piperidinedicarboxylic acid [ACD/IUPAC Name]
(3R,5S)-Piperidine-3,5-dicarboxylic acid
3,5-Piperidinedicarboxylic acid, (3R,5S)- [ACD/Index Name]
Acide (3R,5S)-3,5-pipéridinedicarboxylique [French] [ACD/IUPAC Name]
(3S,5R)-piperidine-3,5-dicarboxylic acid
(5S,3R)piperidine-3,5-dicarboxylic acid
[876367-84-9]
3,5-Piperidinedicarboxylicacid, (3R,5S)-rel-
876367-84-9 [RN]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

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: -0.70
ACD/LogD (pH 5.5): -4.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.28
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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