ChemSpider 2D Image | (2S,4R)-4-(2-Phosphono-2-propanyl)-2-piperidinecarboxylic acid | C9H18NO5P

(2S,4R)-4-(2-Phosphono-2-propanyl)-2-piperidinecarboxylic acid

  • Molecular FormulaC9H18NO5P
  • Average mass251.217 Da
  • Monoisotopic mass251.092255 Da
  • ChemSpider ID23133267

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S,4R)-4-(2-Phosphono-2-propanyl)-2-piperidincarbonsäure [German] [ACD/IUPAC Name]
(2S,4R)-4-(2-Phosphono-2-propanyl)-2-piperidinecarboxylic acid [ACD/IUPAC Name]
2-Piperidinecarboxylic acid, 4-(1-methyl-1-phosphonoethyl)-, (2S,4R)- [ACD/Index Name]
Acide (2S,4R)-4-(2-phosphono-2-propanyl)-2-pipéridinecarboxylique [French] [ACD/IUPAC Name]
(2S,4R)-4-(2-phosphonopropan-2-yl)piperidine-2-carboxylic acid
4-(1-Methyl-1-phosphono-ethyl)-piperidine-2-carboxylic acid
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL290293/

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

Density: 1.4±0.1 g/cm3
Boiling Point: 490.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 82.9±6.0 kJ/mol
Flash Point: 250.4±31.5 °C
Index of Refraction: 1.522
Molar Refractivity: 56.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -1.61
ACD/LogD (pH 5.5): -4.71
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.84
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 117 Å2
Polarizability: 22.2±0.5 10-24cm3
Surface Tension: 59.0±3.0 dyne/cm
Molar Volume: 183.6±3.0 cm3

Click to predict properties on the Chemicalize site


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