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Search term: SMCAMLBVPBWGKN-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 2-Amino-4-(2-fluoro-4-pentylphenyl)-2-(hydroxymethyl)butyl dihydrogen phosphate | C16H27FNO5P

2-Amino-4-(2-fluoro-4-pentylphenyl)-2-(hydroxymethyl)butyl dihydrogen phosphate

  • Molecular FormulaC16H27FNO5P
  • Average mass363.361 Da
  • Monoisotopic mass363.161072 Da
  • ChemSpider ID24671877

More details:

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

1,3-Propanediol, 2-amino-2-[2-(2-fluoro-4-pentylphenyl)ethyl]-, mono(dihydrogen phosphate) (ester) [ACD/Index Name]
2-Amino-4-(2-fluor-4-pentylphenyl)-2-(hydroxymethyl)butyldihydrogenphosphat [German] [ACD/IUPAC Name]
2-Amino-4-(2-fluoro-4-pentylphenyl)-2-(hydroxymethyl)butyl dihydrogen phosphate [ACD/IUPAC Name]
Dihydrogénophosphate de 2-amino-4-(2-fluoro-4-pentylphényl)-2-(hydroxyméthyl)butyle [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: 561.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.8±3.0 kJ/mol
Flash Point: 293.1±32.9 °C
Index of Refraction: 1.543
Molar Refractivity: 89.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 2.72
ACD/LogD (pH 5.5): -1.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 123 Å2
Polarizability: 35.6±0.5 10-24cm3
Surface Tension: 53.9±3.0 dyne/cm
Molar Volume: 285.1±3.0 cm3

Click to predict properties on the Chemicalize site


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