Compound C34H32FeN4O4

3-[18-(2-carboxyethyl)-8,13-bis(ethenyl)-3,7,12,17-tetramethylporphyrin-21,23-diid-2-yl]propanoic acid;iron(2+)

CAS: 14875-96-8

Molecular Formula	`C34H32FeN4O4`
Molecular Weight	616.5 g/mol
Topological Polar Surface Area	101.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	8
Rotatable Bonds	8
Exact Mass	616.1773
Heavy Atoms	43
Complexity	1580.0

Chemical Identifiers

CAS Number	14875-96-8
SMILES	`CC1=C(C2=CC3=NC(=CC4=C(C(=C([N-]4)C=C5C(=C(C(=N5)C=C1[N-]2)C)C=C)C)C=C)C(=C3CCC(=O)O)C)CCC(=O)O.[Fe+2]`
InChIKey	`KABFMIBPWCXCRK-UHFFFAOYSA-L`

📖 Product Overview

Compound C34H32FeN4O4 (CAS: 14875-96-8) is a chemical compound with molecular formula C34H32FeN4O4 and molecular weight 616.5 g/mol. Its IUPAC systematic name is 3-[18-(2-carboxyethyl)-8,13-bis(ethenyl)-3,7,12,17-tetramethylporphyrin-21,23-diid-2-yl]propanoic acid;iron(2+). Topological Polar Surface Area 101.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 8 Rotatable Bonds 8 Exact Mass 616.1773 Heavy Atoms 43 Complexity 1580.0 InChI Key: KABFMIBPWCXCRK-UHFFFAOYSA-L. SMILES: CC1=C(C2=CC3=NC(=CC4=C(C(=C([N-]4)C=C5C(=C(C(=N5)C=C1[N-]2)C)C=C)C)C=C)C(=C3CCC(=O)O)C)CCC(=O)O.[Fe+2].

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