ChemSpider 2D Image | pheophorbide b | C35H34N4O6

pheophorbide b

  • Molecular FormulaC35H34N4O6
  • Average mass606.668 Da
  • Monoisotopic mass606.247864 Da
  • ChemSpider ID10381281

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 3 of 3 defined stereocentres

More details:

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

20239-99-0 [RN]
243-626-1 [EINECS]
3-[(3S,4S,21R)-14-Ethyl-13-formyl-21-(methoxycarbonyl)-4,8,18-trimethyl-20-oxo-9-vinyl-3-phorbinyl]propansäure [German] [ACD/IUPAC Name]
4-26-00-03284 [Beilstein]
Acide 3-[(3S,4S,21R)-14-éthyl-13-formyl-21-(méthoxycarbonyl)-4,8,18-triméthyl-20-oxo-9-vinyl-3-phorbinyl]propanoïque [French] [ACD/IUPAC Name]
pheophorbide b
1208232 [Beilstein]
75945 [Beilstein]
Phaeophorbid b
Phaeophorbid-b
More...

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

1208232; 75945 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 1085.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 166.9±3.0 kJ/mol
Flash Point: 610.3±34.3 °C
Index of Refraction: 1.664
Molar Refractivity: 166.4±0.3 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 5.66
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: 155 Å2
Polarizability: 65.9±0.5 10-24cm3
Surface Tension: 67.1±3.0 dyne/cm
Molar Volume: 448.8±3.0 cm3

Click to predict properties on the Chemicalize site


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