ChemSpider 2D Image | [3-(2-Amino-5-propyl-1,3-thiazol-4-yl)phenyl]phosphonic acid | C12H15N2O3PS

[3-(2-Amino-5-propyl-1,3-thiazol-4-yl)phenyl]phosphonic acid

  • Molecular FormulaC12H15N2O3PS
  • Average mass298.298 Da
  • Monoisotopic mass298.054108 Da
  • ChemSpider ID26389409

More details:






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

[3-(2-Amino-5-propyl-1,3-thiazol-4-yl)phenyl]phosphonic acid [ACD/IUPAC Name]
[3-(2-Amino-5-propyl-1,3-thiazol-4-yl)phenyl]phosphonsäure [German] [ACD/IUPAC Name]
Acide [3-(2-amino-5-propyl-1,3-thiazol-4-yl)phényl]phosphonique [French] [ACD/IUPAC Name]
Phosphonic acid, [3-(2-amino-5-propyl-4-thiazolyl)phenyl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 599.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.9±3.0 kJ/mol
Flash Point: 316.5±32.9 °C
Index of Refraction: 1.646
Molar Refractivity: 74.7±0.4 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.98
ACD/LogD (pH 5.5): -1.88
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 134 Å2
Polarizability: 29.6±0.5 10-24cm3
Surface Tension: 76.2±5.0 dyne/cm
Molar Volume: 205.7±5.0 cm3

Click to predict properties on the Chemicalize site






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