ChemSpider 2D Image | 3,3,7,7,12,13,17,18-Octaethyl-2,8-dimethyl-2,3,7,8-tetrahydroporphyrin | C38H54N4

3,3,7,7,12,13,17,18-Octaethyl-2,8-dimethyl-2,3,7,8-tetrahydroporphyrin

  • Molecular FormulaC38H54N4
  • Average mass566.862 Da
  • Monoisotopic mass566.434875 Da
  • ChemSpider ID168812

  • Double-bond stereo - Double-bond stereo

More details:

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

21H,22H-Porphine, 2,3,7,8,13,13,17,17-octaethyl-12,13,17,18-tetrahydro-12,18-dimethyl- [ACD/Index Name]
3,3,7,7,12,13,17,18-Octaethyl-2,8-dimethyl-2,3,7,8-tetrahydroporphyrin [ACD/IUPAC Name]
3,3,7,7,12,13,17,18-Octaethyl-2,8-dimethyl-2,3,7,8-tetrahydroporphyrin [German] [ACD/IUPAC Name]
3,3,7,7,12,13,17,18-Octaéthyl-2,8-diméthyl-2,3,7,8-tétrahydroporphyrine [French] [ACD/IUPAC Name]
1,4-Dmoeibc
21H,23H-Porphine, 2,2,7,8,12,13,18,18-octaethyl-2,3,17,18-tetrahydro-3,17-dimethyl- [ACD/Index Name]
74071-45-7 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 728.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 102.6±3.0 kJ/mol
Flash Point: 293.5±25.8 °C
Index of Refraction: 1.540
Molar Refractivity: 176.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 13.35
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: 69.8±0.5 10-24cm3
Surface Tension: 41.2±3.0 dyne/cm
Molar Volume: 561.1±3.0 cm3

Click to predict properties on the Chemicalize site


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