ChemSpider 2D Image | 3,3',3'',3'''-(5,10,15,20-Tetramethyl-5,10,15,20,22,24-hexahydroporphyrin-5,10,15,20-tetrayl)tetrapropanoic acid | C36H44N4O8

3,3',3'',3'''-(5,10,15,20-Tetramethyl-5,10,15,20,22,24-hexahydroporphyrin-5,10,15,20-tetrayl)tetrapropanoic acid

  • Molecular FormulaC36H44N4O8
  • Average mass660.757 Da
  • Monoisotopic mass660.315918 Da
  • ChemSpider ID9654188

More details:

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

21H,23H-Porphine-5,10,15,20-tetrapropanoic acid, 5,10,15,20,22,24-hexahydro-5,10,15,20-tetramethyl- [ACD/Index Name]
3,3',3'',3'''-(5,10,15,20-Tetramethyl-5,10,15,20,22,24-hexahydroporphyrin-5,10,15,20-tetrayl)tetrapropanoic acid [ACD/IUPAC Name]
3,3',3'',3'''-(5,10,15,20-Tetramethyl-5,10,15,20,22,24-hexahydroporphyrin-5,10,15,20-tetrayl)tetrapropansäure [German] [ACD/IUPAC Name]
Acide 3,3',3'',3'''-(5,10,15,20-tétraméthyl-5,10,15,20,22,24-hexahydroporphyrine-5,10,15,20-tétrayl)tetrapropanoïque [French] [ACD/IUPAC 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: 931.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 141.9±3.0 kJ/mol
Flash Point: 516.9±32.9 °C
Index of Refraction: 1.597
Molar Refractivity: 175.1±0.3 cm3
#H bond acceptors: 12
#H bond donors: 8
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: 3.17
ACD/LogD (pH 5.5): 0.80
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.21
ACD/LogD (pH 7.4): -2.73
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 212 Å2
Polarizability: 69.4±0.5 10-24cm3
Surface Tension: 63.3±3.0 dyne/cm
Molar Volume: 513.9±3.0 cm3

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