Found 1 result

Search term: BVRCUEHFCXFAMN-RDXHHOOHSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-(2-Methylphenyl)-2-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-piperidinyl]acetamide | C15H22N2O4

N-(2-Methylphenyl)-2-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-piperidinyl]acetamide

  • Molecular FormulaC15H22N2O4
  • Average mass294.346 Da
  • Monoisotopic mass294.157959 Da
  • ChemSpider ID30839660

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

2-Piperidineacetamide, 3,4,5-trihydroxy-6-methyl-N-(2-methylphenyl)-, (2R,3R,4R,5R,6S)- [ACD/Index Name]
N-(2-Methylphenyl)-2-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-piperidinyl]acetamid [German] [ACD/IUPAC Name]
N-(2-Methylphenyl)-2-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-piperidinyl]acetamide [ACD/IUPAC Name]
N-(2-Méthylphényl)-2-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-méthyl-2-pipéridinyl]acétamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 528.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.6±3.0 kJ/mol
Flash Point: 273.6±30.1 °C
Index of Refraction: 1.611
Molar Refractivity: 79.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 0.48
ACD/LogD (pH 5.5): -1.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 17.62
Polar Surface Area: 102 Å2
Polarizability: 31.4±0.5 10-24cm3
Surface Tension: 52.2±3.0 dyne/cm
Molar Volume: 228.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement