ChemSpider 2D Image | (2R,4R)-2-(Hydroxymethyl)-3,4-piperidinediol | C6H13NO3

(2R,4R)-2-(Hydroxymethyl)-3,4-piperidinediol

  • Molecular FormulaC6H13NO3
  • Average mass147.172 Da
  • Monoisotopic mass147.089539 Da
  • ChemSpider ID23157276

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

(2R,4R)-2-(Hydroxymethyl)-3,4-piperidindiol [German] [ACD/IUPAC Name]
(2R,4R)-2-(Hydroxymethyl)-3,4-piperidinediol [ACD/IUPAC Name]
(2R,4R)-2-(Hydroxyméthyl)-3,4-pipéridinediol [French] [ACD/IUPAC Name]
3,4-Piperidinediol, 2-(hydroxymethyl)-, (2R,4R)- [ACD/Index Name]
(2R,4R)-2-(hydroxymethyl)piperidine-3,4-diol
2-Hydroxymethyl-piperidine-3,4-diol
53185-12-9 [RN]
fagomine
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL303545/

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

Density: 1.3±0.1 g/cm3
Boiling Point: 315.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 64.5±6.0 kJ/mol
Flash Point: 170.5±18.5 °C
Index of Refraction: 1.535
Molar Refractivity: 35.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.63
ACD/LogD (pH 5.5): -4.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 73 Å2
Polarizability: 14.2±0.5 10-24cm3
Surface Tension: 51.1±3.0 dyne/cm
Molar Volume: 115.0±3.0 cm3

Click to predict properties on the Chemicalize site


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