ChemSpider 2D Image | N-{3-Acetyl-4-[(2S)-2-hydroxy-3-(isopropylamino)propoxy]phenyl}acetamide | C16H24N2O4

N-{3-Acetyl-4-[(2S)-2-hydroxy-3-(isopropylamino)propoxy]phenyl}acetamide

  • Molecular FormulaC16H24N2O4
  • Average mass308.373 Da
  • Monoisotopic mass308.173615 Da
  • ChemSpider ID34984627

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

91050-36-1 [RN]
Acetamide, N-[3-acetyl-4-[(2S)-2-hydroxy-3-[(1-methylethyl)amino]propoxy]phenyl]- [ACD/Index Name]
N-{3-Acetyl-4-[(2S)-2-hydroxy-3-(isopropylamino)propoxy]phenyl}acetamid [German] [ACD/IUPAC Name]
N-{3-Acetyl-4-[(2S)-2-hydroxy-3-(isopropylamino)propoxy]phenyl}acetamide [ACD/IUPAC Name]
N-{3-Acétyl-4-[(2S)-2-hydroxy-3-(isopropylamino)propoxy]phényl}acétamide [French] [ACD/IUPAC Name]
22568-64-5 [RN]
245-088-3 [EINECS]
87833-60-1 [RN]
Acetamide, N-(3-acetyl-4-((2R)-2-hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)-
Diacetolol [Wiki]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

461S74EMFT [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 548.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.2±3.0 kJ/mol
Flash Point: 285.7±30.1 °C
Index of Refraction: 1.551
Molar Refractivity: 85.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 0.89
ACD/LogD (pH 5.5): -2.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 88 Å2
Polarizability: 33.9±0.5 10-24cm3
Surface Tension: 44.5±3.0 dyne/cm
Molar Volume: 267.7±3.0 cm3

Click to predict properties on the Chemicalize site


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