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Search term: QFOYLAGRMXUVSR (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 3-[18-(3-Methoxy-3-oxopropyl)-3,7,12,17-tetramethyl-8,13-divinyl-2-porphyrinyl]propanoic acid | C35H36N4O4

3-[18-(3-Methoxy-3-oxopropyl)-3,7,12,17-tetramethyl-8,13-divinyl-2-porphyrinyl]propanoic acid

  • Molecular FormulaC35H36N4O4
  • Average mass576.685 Da
  • Monoisotopic mass576.273682 Da
  • ChemSpider ID146542
  • Double-bond stereo - Double-bond stereo


More details:






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

21H,22H-Porphine-13,17-dipropanoic acid, 2,7-diethenyl-3,8,12,18-tetramethyl-, 17-methyl ester [ACD/Index Name]
3-[18-(3-Methoxy-3-oxopropyl)-3,7,12,17-tetramethyl-8,13-divinyl-2-porphyrinyl]propanoic acid [ACD/IUPAC Name]
3-[18-(3-Methoxy-3-oxopropyl)-3,7,12,17-tetramethyl-8,13-divinyl-2-porphyrinyl]propansäure [German] [ACD/IUPAC Name]
Acide 3-[18-(3-méthoxy-3-oxopropyl)-3,7,12,17-tétraméthyl-8,13-divinyl-2-porphyrineyl]propanoïque [French] [ACD/IUPAC Name]
16053-68-2 [RN]
21H,23H-Porphine-2,18-dipropanoic acid, 7,12-diethenyl-3,8,13,17-tetramethyl-, 18-methyl ester
Mgprotome
Mg-Protoporphyrin IX monomethyl ester
protoporphyrin IX monomethyl ester

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 1073.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 164.9±3.0 kJ/mol
Flash Point: 603.0±34.3 °C
Index of Refraction: 1.633
Molar Refractivity: 167.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 7.93
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: 121 Å2
Polarizability: 66.4±0.5 10-24cm3
Surface Tension: 55.2±3.0 dyne/cm
Molar Volume: 468.4±3.0 cm3

Click to predict properties on the Chemicalize site






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