ChemSpider 2D Image | 3,3'-[7,12-Bis(2-hydroxyethyl)-3,8,13,17-tetramethyl-2,18-porphyrindiyl]dipropanoic acid | C34H38N4O6

3,3'-[7,12-Bis(2-hydroxyethyl)-3,8,13,17-tetramethyl-2,18-porphyrindiyl]dipropanoic acid

  • Molecular FormulaC34H38N4O6
  • Average mass598.689 Da
  • Monoisotopic mass598.279114 Da
  • ChemSpider ID22529523
  • Double-bond stereo - Double-bond stereo


More details:






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

3,3'-[7,12-Bis(2-hydroxyethyl)-3,8,13,17-tetramethyl-2,18-porphyrindiyl]dipropansäure [German] [ACD/IUPAC Name]
Acide 3,3'-[7,12-bis(2-hydroxyéthyl)-3,8,13,17-tétraméthyl-2,18-porphyrinediyl]dipropanoïque [French] [ACD/IUPAC Name]
3819-29-2 [RN]
8,13-Bis(2-hydroxyethyl)-3,7,12,17-tetramethyl-21H,23H-porphine-2,18-dipropionic acid
885267-28-7 [RN]
Isohematoporphyrin IX
MFCD08669590 [MDL number]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 1190.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 184.8±3.0 kJ/mol
Flash Point: 673.8±34.3 °C
Index of Refraction: 1.640
Molar Refractivity: 162.9±0.3 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: 4.84
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: 172 Å2
Polarizability: 64.6±0.5 10-24cm3
Surface Tension: 66.3±3.0 dyne/cm
Molar Volume: 451.8±3.0 cm3

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