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Search term: RQWYWHUKHYFIPB (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 1-[1'-(3-phenylacryloyl)spiro[1-benzofuran-3,4'-piperidin]-5-yl]methanamine | C22H24N2O2

1-[1'-(3-phenylacryloyl)spiro[1-benzofuran-3,4'-piperidin]-5-yl]methanamine

  • Molecular FormulaC22H24N2O2
  • Average mass348.438 Da
  • Monoisotopic mass348.183777 Da
  • ChemSpider ID25057952
  • Double-bond stereo - Double-bond stereo


More details:






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

(2E)-1-[5-(Aminomethyl)-1'H-spiro[1-benzofuran-3,4'-piperidin]-1'-yl]-3-phenyl-2-propen-1-on [German] [ACD/IUPAC Name]
(2E)-1-[5-(Aminomethyl)-1'H-spiro[1-benzofuran-3,4'-piperidin]-1'-yl]-3-phenyl-2-propen-1-one [ACD/IUPAC Name]
(2E)-1-[5-(Aminométhyl)-1'H-spiro[1-benzofuran-3,4'-piperidin]-1'-yl]-3-phényl-2-propén-1-one [French] [ACD/IUPAC Name]
1-[1'-(3-phenylacryloyl)spiro[1-benzofuran-3,4'-piperidin]-5-yl]methanamine
2-Propen-1-one, 1-[5-(aminomethyl)spiro[benzofuran-3(2H),4'-piperidin]-1'-yl]-3-phenyl-, (2E)- [ACD/Index Name]
(2E)-1-[5-(aminomethyl)-2H-spiro[1-benzofuran-3,4'-piperidine]-1'-yl]-3-phenylprop-2-en-1-one
11N

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

Density: 1.2±0.1 g/cm3
Boiling Point: 583.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.3±3.0 kJ/mol
Flash Point: 306.9±30.1 °C
Index of Refraction: 1.651
Molar Refractivity: 103.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.85
ACD/LogD (pH 5.5): -0.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.65
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.85
Polar Surface Area: 56 Å2
Polarizability: 40.8±0.5 10-24cm3
Surface Tension: 59.0±5.0 dyne/cm
Molar Volume: 281.8±5.0 cm3

Click to predict properties on the Chemicalize site






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