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Search term: NBRBAASYQVVTDE (Found by InChIKey (skeleton match))
ChemSpider 2D Image | N-[2-(2,5-Dimethoxyphenyl)ethyl]-1-propanamine | C13H21NO2

N-[2-(2,5-Dimethoxyphenyl)ethyl]-1-propanamine

  • Molecular FormulaC13H21NO2
  • Average mass223.311 Da
  • Monoisotopic mass223.157227 Da
  • ChemSpider ID25470401

More details:

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

Benzeneethanamine, 2,5-dimethoxy-N-propyl- [ACD/Index Name]
N-[2-(2,5-Dimethoxyphenyl)ethyl]-1-propanamin [German] [ACD/IUPAC Name]
N-[2-(2,5-Dimethoxyphenyl)ethyl]-1-propanamine [ACD/IUPAC Name]
N-[2-(2,5-Diméthoxyphényl)éthyl]-1-propanamine [French] [ACD/IUPAC Name]
MFCD11937801 [MDL number]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 322.8±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.5±3.0 kJ/mol
Flash Point: 135.6±13.2 °C
Index of Refraction: 1.495
Molar Refractivity: 66.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.54
ACD/LogD (pH 5.5): -0.67
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.10
Polar Surface Area: 30 Å2
Polarizability: 26.4±0.5 10-24cm3
Surface Tension: 32.2±3.0 dyne/cm
Molar Volume: 228.6±3.0 cm3

Click to predict properties on the Chemicalize site


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