ChemSpider 2D Image | (5'E)-4'-Methoxy-5'-[(5-undecyl-1H-pyrrol-2-yl)methylene]-1H,5'H-2,2'-bipyrrole | C25H35N3O

(5'E)-4'-Methoxy-5'-[(5-undecyl-1H-pyrrol-2-yl)methylene]-1H,5'H-2,2'-bipyrrole

  • Molecular FormulaC25H35N3O
  • Average mass393.565 Da
  • Monoisotopic mass393.278015 Da
  • ChemSpider ID26540041

More details:

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

(5'E)-4'-Methoxy-5'-[(5-undecyl-1H-pyrrol-2-yl)methylen]-1H,5'H-2,2'-bipyrrol [German] [ACD/IUPAC Name]
(5'E)-4'-Methoxy-5'-[(5-undecyl-1H-pyrrol-2-yl)methylene]-1H,5'H-2,2'-bipyrrole [ACD/IUPAC Name]
(5'E)-4'-Méthoxy-5'-[(5-undécyl-1H-pyrrol-2-yl)méthylène]-1H,5'H-2,2'-bipyrrole [French] [ACD/IUPAC Name]
1H-Pyrrole, 2-[(E)-[3-methoxy-5-(1H-pyrrol-2-yl)-2H-pyrrol-2-ylidene]methyl]-5-undecyl- [ACD/Index Name]
13129-81-2 [RN]
1H-Pyrrole, 2-[[3-methoxy-5-(1H-pyrrol-2-yl)-2H-pyrrol-2-ylidene]methyl]-5-undecyl- [ACD/Index Name]
4'-Methoxy-5'-[(5-undecyl-1H-pyrrol-2-yl)methylen]-1H,5'H-2,2'-bipyrrol [German] [ACD/IUPAC Name]
4'-Methoxy-5'-[(5-undecyl-1H-pyrrol-2-yl)methylene]-1H,5'H-2,2'-bipyrrole [ACD/IUPAC Name]
4'-Méthoxy-5'-[(5-undécyl-1H-pyrrol-2-yl)méthylène]-1H,5'H-2,2'-bipyrrole [French] [ACD/IUPAC Name]
Undecylprodigiosin

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

Density: 1.1±0.1 g/cm3
Boiling Point: 582.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 83.9±3.0 kJ/mol
Flash Point: 306.3±30.1 °C
Index of Refraction: 1.567
Molar Refractivity: 120.3±0.5 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 7.35
ACD/LogD (pH 5.5): 7.25
ACD/BCF (pH 5.5): 181328.77
ACD/KOC (pH 5.5): 189212.94
ACD/LogD (pH 7.4): 7.35
ACD/BCF (pH 7.4): 227925.47
ACD/KOC (pH 7.4): 237835.66
Polar Surface Area: 53 Å2
Polarizability: 47.7±0.5 10-24cm3
Surface Tension: 38.8±7.0 dyne/cm
Molar Volume: 368.2±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement