ChemSpider 2D Image | (3E)-2-(4-Fluorophenyl)-3-[(4-methoxyphenyl)imino]-4-(1-pyrrolidinyl)-2-azaspiro[4.5]decane-1-thione | C26H30FN3OS

(3E)-2-(4-Fluorophenyl)-3-[(4-methoxyphenyl)imino]-4-(1-pyrrolidinyl)-2-azaspiro[4.5]decane-1-thione

  • Molecular FormulaC26H30FN3OS
  • Average mass451.599 Da
  • Monoisotopic mass451.209351 Da
  • ChemSpider ID22972236

  • Double-bond stereo - Double-bond stereo

More details:

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

(3E)-2-(4-Fluorophenyl)-3-[(4-methoxyphenyl)imino]-4-(1-pyrrolidinyl)-2-azaspiro[4.5]decane-1-thione [ACD/IUPAC Name]
(3E)-2-(4-Fluorophényl)-3-[(4-méthoxyphényl)imino]-4-(1-pyrrolidinyl)-2-azaspiro[4.5]décane-1-thione [French] [ACD/IUPAC Name]
(3E)-2-(4-Fluorphenyl)-3-[(4-methoxyphenyl)imino]-4-(1-pyrrolidinyl)-2-azaspiro[4.5]decan-1-thion [German] [ACD/IUPAC Name]
2-Azaspiro[4.5]decane-1-thione, 2-(4-fluorophenyl)-3-[(4-methoxyphenyl)imino]-4-(1-pyrrolidinyl)-, (3E)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 585.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.4±3.0 kJ/mol
Flash Point: 307.7±32.9 °C
Index of Refraction: 1.645
Molar Refractivity: 129.5±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.36
ACD/LogD (pH 5.5): 4.20
ACD/BCF (pH 5.5): 547.90
ACD/KOC (pH 5.5): 1722.92
ACD/LogD (pH 7.4): 5.10
ACD/BCF (pH 7.4): 4301.47
ACD/KOC (pH 7.4): 13526.43
Polar Surface Area: 60 Å2
Polarizability: 51.3±0.5 10-24cm3
Surface Tension: 45.6±7.0 dyne/cm
Molar Volume: 357.1±7.0 cm3

Click to predict properties on the Chemicalize site


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