Found 12 results

Search term: MF = 'C_{22}H_{28}NO_{4}P'
ChemSpider 2D Image | {(1R,3S)-1-Amino-3-[(6S)-6-phenyl-5,6,7,8-tetrahydro-2-naphthalenyl]cyclopentyl}methyl dihydrogen phosphate | C22H28NO4P

{(1R,3S)-1-Amino-3-[(6S)-6-phenyl-5,6,7,8-tetrahydro-2-naphthalenyl]cyclopentyl}methyl dihydrogen phosphate

  • Molecular FormulaC22H28NO4P
  • Average mass401.436 Da
  • Monoisotopic mass401.175598 Da
  • ChemSpider ID129147015

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

{(1R,3S)-1-Amino-3-[(6S)-6-phenyl-5,6,7,8-tetrahydro-2-naphthalenyl]cyclopentyl}methyl dihydrogen phosphate [ACD/IUPAC Name]
{(1R,3S)-1-Amino-3-[(6S)-6-phenyl-5,6,7,8-tetrahydro-2-naphthalinyl]cyclopentyl}methyldihydrogenphosphat [German] [ACD/IUPAC Name]
Cyclopentanemethanol, 1-amino-3-[(6S)-5,6,7,8-tetrahydro-6-phenyl-2-naphthalenyl]-, dihydrogen phosphate (ester), (1R,3S)- [ACD/Index Name]
Dihydrogénophosphate de {(1R,3S)-1-amino-3-[(6S)-6-phényl-5,6,7,8-tétrahydro-2-naphtalényl]cyclopentyl}méthyle [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: 594.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.2±3.0 kJ/mol
Flash Point: 313.2±32.9 °C
Index of Refraction: 1.602
Molar Refractivity: 108.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.60
ACD/LogD (pH 5.5): 0.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.26
ACD/LogD (pH 7.4): -0.47
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 103 Å2
Polarizability: 43.0±0.5 10-24cm3
Surface Tension: 59.0±3.0 dyne/cm
Molar Volume: 316.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement