ChemSpider 2D Image | [3-(7,12-Diethyl-3,8,13,17-tetramethyl-18-{[(2S)-3-oxo-2-oxiranyl]methyl}-2-porphyrinyl-kappa~2~N~22~,N~24~)propanoato(2-)]iron | C34H34FeN4O4

[3-(7,12-Diethyl-3,8,13,17-tetramethyl-18-{[(2S)-3-oxo-2-oxiranyl]methyl}-2-porphyrinyl-κ2N22,N24)propanoato(2-)]iron

  • Molecular FormulaC34H34FeN4O4
  • Average mass618.503 Da
  • Monoisotopic mass618.192932 Da
  • ChemSpider ID61714820

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

[3-(7,12-Diéthyl-3,8,13,17-tétraméthyl-18-{[(2S)-3-oxo-2-oxiranyl]méthyl}-2-porphyrineyl-κ2N22,N24)propanato(2-)]fer [French] [ACD/IUPAC Name]
[3-(7,12-Diethyl-3,8,13,17-tetramethyl-18-{[(2S)-3-oxo-2-oxiranyl]methyl}-2-porphyrinyl-κ2N22,N24)propanoato(2-)]eisen [German] [ACD/IUPAC Name]
[3-(7,12-Diethyl-3,8,13,17-tetramethyl-18-{[(2S)-3-oxo-2-oxiranyl]methyl}-2-porphyrinyl-κ2N22,N24)propanoato(2-)]iron [ACD/IUPAC Name]
Iron, [12,17-diethyl-2,8,13,18-tetramethyl-3-[[(2S)-3-oxooxiranyl]methyl]-21H,23H-porphine-7-propanoato(2-)-κN21,κN23]- [ACD/Index Name]
Hem
protoporphyrin ix containing fe

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations:
ACD/LogP:
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: 100 Å2
Polarizability:
Surface Tension:
Molar Volume:

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