ChemSpider 2D Image | 1'-[2-(3,4-Difluorophenyl)-2-hydroxyethyl]-6-methoxy-3,4-dihydrospiro[chromene-2,4'-piperidin]-4-ol | C22H25F2NO4

1'-[2-(3,4-Difluorophenyl)-2-hydroxyethyl]-6-methoxy-3,4-dihydrospiro[chromene-2,4'-piperidin]-4-ol

  • Molecular FormulaC22H25F2NO4
  • Average mass405.435 Da
  • Monoisotopic mass405.175171 Da
  • ChemSpider ID22512003

More details:

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

1'-[2-(3,4-Difluorophenyl)-2-hydroxyethyl]-6-methoxy-3,4-dihydrospiro[chromene-2,4'-piperidin]-4-ol [ACD/IUPAC Name]
1'-[2-(3,4-Difluorophényl)-2-hydroxyéthyl]-6-méthoxy-3,4-dihydrospiro[chromene-2,4'-piperidin]-4-ol [French] [ACD/IUPAC Name]
1'-[2-(3,4-Difluorphenyl)-2-hydroxyethyl]-6-methoxy-3,4-dihydrospiro[chromene-2,4'-piperidin]-4-ol [German] [ACD/IUPAC Name]
Spiro[2H-1-benzopyran-2,4'-piperidine]-1'-ethanol, α-(3,4-difluorophenyl)-3,4-dihydro-4-hydroxy-6-methoxy- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 547.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 87.1±3.0 kJ/mol
Flash Point: 285.1±30.1 °C
Index of Refraction: 1.615
Molar Refractivity: 104.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.99
ACD/LogD (pH 5.5): 0.60
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.21
ACD/LogD (pH 7.4): 2.31
ACD/BCF (pH 7.4): 23.23
ACD/KOC (pH 7.4): 214.60
Polar Surface Area: 62 Å2
Polarizability: 41.3±0.5 10-24cm3
Surface Tension: 57.6±5.0 dyne/cm
Molar Volume: 299.0±5.0 cm3

Click to predict properties on the Chemicalize site


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