ChemSpider 2D Image | 2-{[(R)-[(1S)-1-Aminoethyl](hydroxy)phosphoryl]methyl}nonanoic acid | C12H26NO4P

2-{[(R)-[(1S)-1-Aminoethyl](hydroxy)phosphoryl]methyl}nonanoic acid

  • Molecular FormulaC12H26NO4P
  • Average mass279.313 Da
  • Monoisotopic mass279.159943 Da
  • ChemSpider ID28515533

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

2-{[(R)-[(1S)-1-Aminoethyl](hydroxy)phosphoryl]methyl}nonanoic acid [ACD/IUPAC Name]
2-{[(R)-[(1S)-1-Aminoethyl](hydroxy)phosphoryl]methyl}nonansäure [German] [ACD/IUPAC Name]
Acide 2-{[(R)-[(1S)-1-aminoéthyl](hydroxy)phosphoryl]méthyl}nonanoïque [French] [ACD/IUPAC Name]
Nonanoic acid, 2-[[(R)-[(1R,1S)-1-aminoethyl]hydroxyphosphinyl]methyl]- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 511.1±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 85.6±6.0 kJ/mol
Flash Point: 262.9±25.9 °C
Index of Refraction: 1.486
Molar Refractivity: 71.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.87
ACD/LogD (pH 5.5): -1.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.76
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 110 Å2
Polarizability: 28.2±0.5 10-24cm3
Surface Tension: 46.0±3.0 dyne/cm
Molar Volume: 247.3±3.0 cm3

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