ChemSpider 2D Image | {3,3'-[8-(1-Hydroxy-5,9,13-trimethyl-4,8,12-tetradecatrien-1-yl)-3,7,12,17-tetramethyl-13-vinyl-2,18-porphyrindiyl-kappa~4~N~21~,N~22~,N~23~,N~24~]dipropanoato(4-)}iron | C49H56FeN4O5

{3,3'-[8-(1-Hydroxy-5,9,13-trimethyl-4,8,12-tetradecatrien-1-yl)-3,7,12,17-tetramethyl-13-vinyl-2,18-porphyrindiyl-κ4N21,N22,N23,N24]dipropanoato(4-)}iron

  • Molecular FormulaC49H56FeN4O5
  • Average mass836.838 Da
  • Monoisotopic mass836.359985 Da
  • ChemSpider ID21233441
  • Charge - Charge

    Double-bond stereo - Double-bond stereo


More details:






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

{3,3'-[8-(1-Hydroxy-5,9,13-trimethyl-4,8,12-tetradecatrien-1-yl)-3,7,12,17-tetramethyl-13-vinyl-2,18-porphyrindiyl4N21,N22,N23,N24]dipropanoato(4-)}eisen [German] [ACD/IUPAC Name]
{3,3'-[8-(1-Hydroxy-5,9,13-trimethyl-4,8,12-tetradecatrien-1-yl)-3,7,12,17-tetramethyl-13-vinyl-2,18-porphyrindiyl4N21,N22,N23,N24]dipropanoato(4-)}iron [ACD/IUPAC Name]
{3,3'-[8-(1-Hydroxy-5,9,13-triméthyl-4,8,12-tétradécatrién-1-yl)-3,7,12,17-tétraméthyl-13-vinyl-2,18-porphyrinediyl-κ4N21,N22,N23,N24]dipropanato(4-)}fer [French] [ACD/IUPAC Name]
Iron, [7-ethenyl-12-(1-hydroxy-5,9,13-trimethyl-4,8,12-tetradecatrien-1-yl)-3,8,13,17-tetramethyl-21H,23H-porphine-2,18-dipropanoato(4-)-κN21,κN22,κN23,κN24]- [ACD/Index Name]

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

Density:
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Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 18
#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: 115 Å2
Polarizability:
Surface Tension:
Molar Volume:

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