ChemSpider 2D Image | [2-(Benzylamino)-1,4-phenylene]bis{[4-(1-pyrrolidinyl)-1-piperidinyl]methanone} | C33H45N5O2

[2-(Benzylamino)-1,4-phenylene]bis{[4-(1-pyrrolidinyl)-1-piperidinyl]methanone}

  • Molecular FormulaC33H45N5O2
  • Average mass543.743 Da
  • Monoisotopic mass543.357300 Da
  • ChemSpider ID30838104

More details:

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

[2-(Benzylamino)-1,4-phenylen]bis{[4-(1-pyrrolidinyl)-1-piperidinyl]methanon} [German] [ACD/IUPAC Name]
[2-(Benzylamino)-1,4-phenylene]bis{[4-(1-pyrrolidinyl)-1-piperidinyl]methanone} [ACD/IUPAC Name]
[2-(Benzylamino)-1,4-phénylène]bis{[4-(1-pyrrolidinyl)-1-pipéridinyl]méthanone} [French] [ACD/IUPAC Name]
Methanone, 1,1'-[2-[(phenylmethyl)amino]-1,4-phenylene]bis[1-[4-(1-pyrrolidinyl)-1-piperidinyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 738.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.7±3.0 kJ/mol
Flash Point: 400.3±32.9 °C
Index of Refraction: 1.638
Molar Refractivity: 160.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.53
ACD/LogD (pH 5.5): -0.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 59 Å2
Polarizability: 63.6±0.5 10-24cm3
Surface Tension: 58.9±3.0 dyne/cm
Molar Volume: 446.6±3.0 cm3

Click to predict properties on the Chemicalize site


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