ChemSpider 2D Image | (2R)-3-{[(1R)-1-Amino-3-methylbutyl](hydroxy)phosphoryl}-2-methylpropanoic acid | C9H20NO4P

(2R)-3-{[(1R)-1-Amino-3-methylbutyl](hydroxy)phosphoryl}-2-methylpropanoic acid

  • Molecular FormulaC9H20NO4P
  • Average mass237.233 Da
  • Monoisotopic mass237.112991 Da
  • ChemSpider ID25058615
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

(2r)-3-[(R)-[(1r)-1-Amino-3-Methylbutyl](Hydroxy)phosphoryl]-2-Methylpropanoic Acid
(2R)-3-{[(1R)-1-Amino-3-methylbutyl](hydroxy)phosphoryl}-2-methylpropanoic acid [ACD/IUPAC Name]
(2R)-3-{[(1R)-1-Amino-3-methylbutyl](hydroxy)phosphoryl}-2-methylpropansäure [German] [ACD/IUPAC Name]
Acide (2R)-3-{[(1R)-1-amino-3-méthylbutyl](hydroxy)phosphoryl}-2-méthylpropanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 3-[[(1R)-1-amino-3-methylbutyl]hydroxyphosphinyl]-2-methyl-, (2R)- [ACD/Index Name]
L3A

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 483.2±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 81.9±6.0 kJ/mol
Flash Point: 246.0±24.6 °C
Index of Refraction: 1.488
Molar Refractivity: 57.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.09
ACD/LogD (pH 5.5): -3.95
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 110 Å2
Polarizability: 22.6±0.5 10-24cm3
Surface Tension: 48.1±3.0 dyne/cm
Molar Volume: 198.2±3.0 cm3

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