ChemSpider 2D Image | 2,3,7,8,12,13,17,18-Octaethylporphyrin | C36H46N4

2,3,7,8,12,13,17,18-Octaethylporphyrin

  • Molecular FormulaC36H46N4
  • Average mass534.777 Da
  • Monoisotopic mass534.372253 Da
  • ChemSpider ID92423

  • Double-bond stereo - Double-bond stereo

More details:

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

2,3,7,8,12,13,17,18-Octaethylporphyrin [ACD/IUPAC Name]
2,3,7,8,12,13,17,18-Octaethylporphyrin [German] [ACD/IUPAC Name]
2,3,7,8,12,13,17,18-Octaéthylporphyrine [French] [ACD/IUPAC Name]
21H,22H-Porphine, 2,3,7,8,12,13,17,18-octaethyl- [ACD/Index Name]
106117-28-6 [RN]
2,3,7,8,12,13,17,18-Octaethyl-21H,23H-porphin
2,3,7,8,12,13,17,18-Octaethyl-21H,23H-porphine
27860-55-5 [RN]
4,5,9,10,14,15,19,20-OCTAETHYL-21,22,23,24-TETRAAZAPENTACYCLO[16.2.1.1,?.1?,––.1–,–?]TETRACOSA-1,3,5,7,9,11,13(22),14,16,18(21),19-UNDECAENE
991-75-3 [RN]
More...

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

ZINC04208852 [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 804.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 113.0±3.0 kJ/mol
Flash Point: 335.0±27.2 °C
Index of Refraction: 1.575
Molar Refractivity: 166.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 13.08
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 57 Å2
Polarizability: 65.8±0.5 10-24cm3
Surface Tension: 43.5±3.0 dyne/cm
Molar Volume: 502.8±3.0 cm3

Click to predict properties on the Chemicalize site


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