ChemSpider 2D Image | Methyl 9,14-diethyl-3-(3-methoxy-3-oxopropyl)-4,8,13,18-tetramethyl-20-oxo-3,4-didehydro-24,25-dihydrophorbine-21-carboxylate | C36H38N4O5

Methyl 9,14-diethyl-3-(3-methoxy-3-oxopropyl)-4,8,13,18-tetramethyl-20-oxo-3,4-didehydro-24,25-dihydrophorbine-21-carboxylate

  • Molecular FormulaC36H38N4O5
  • Average mass606.711 Da
  • Monoisotopic mass606.284241 Da
  • ChemSpider ID4590262

  • Double-bond stereo - Double-bond stereo

More details:

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

Methyl 9,14-diethyl-3-(3-methoxy-3-oxopropyl)-4,8,13,18-tetramethyl-20-oxo-3,4-didehydro-24,25-dihydrophorbine-21-carboxylate [ACD/IUPAC Name]
Methyl-9,14-diethyl-3-(3-methoxy-3-oxopropyl)-4,8,13,18-tetramethyl-20-oxo-3,4-didehydro-24,25-dihydrophorbin-21-carboxylat [German] [ACD/IUPAC Name]
119282-43-8 [RN]
29169-79-7 [RN]
5522-67-8 [RN]
Me-Php-a5
Methyl phaeoporphyrin a(5)

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

Density: 1.3±0.1 g/cm3
Boiling Point: 1081.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 159.0±3.0 kJ/mol
Flash Point: 607.6±34.3 °C
Index of Refraction: 1.639
Molar Refractivity: 165.4±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 7.74
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: 127 Å2
Polarizability: 65.6±0.5 10-24cm3
Surface Tension: 66.5±5.0 dyne/cm
Molar Volume: 460.0±5.0 cm3

Click to predict properties on the Chemicalize site


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