ChemSpider 2D Image | L-alpha-Acetyl-N,N-dinormethadol | C21H27NO2

L-α-Acetyl-N,N-dinormethadol

  • Molecular FormulaC21H27NO2
  • Average mass325.445 Da
  • Monoisotopic mass325.204193 Da
  • ChemSpider ID25046019

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3S,6S)-6-Amino-4,4-diphenyl-3-heptanyl acetate [ACD/IUPAC Name]
(3S,6S)-6-Amino-4,4-diphenyl-3-heptanyl-acetat [German] [ACD/IUPAC Name]
54276-34-5 [RN]
Acétate de (3S,6S)-6-amino-4,4-diphényl-3-heptanyle [French] [ACD/IUPAC Name]
Benzeneethanol, β-[(2S)-2-aminopropyl]-α-ethyl-β-phenyl-, acetate (ester), (αS)- [ACD/Index Name]
L-α-Acetyl-N,N-dinormethadol
Dinor-laam

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

Density: 1.1±0.1 g/cm3
Boiling Point: 454.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.4±3.0 kJ/mol
Flash Point: 273.4±26.3 °C
Index of Refraction: 1.542
Molar Refractivity: 97.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.38
ACD/LogD (pH 5.5): 1.37
ACD/BCF (pH 5.5): 1.18
ACD/KOC (pH 5.5): 5.22
ACD/LogD (pH 7.4): 2.08
ACD/BCF (pH 7.4): 6.01
ACD/KOC (pH 7.4): 26.67
Polar Surface Area: 52 Å2
Polarizability: 38.6±0.5 10-24cm3
Surface Tension: 39.6±3.0 dyne/cm
Molar Volume: 309.7±3.0 cm3

Click to predict properties on the Chemicalize site


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