Protoporphyrin IX diethyl structure

Protoporphyrin IX diethyl

ethyl 3-[8,13-bis(ethenyl)-18-(3-ethoxy-3-oxopropyl)-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoate

Also Known As: Protoporphyrin IX diethyl|Protoporphyrin diethyl ester|J1.956.576I|J3.725.152F|Diethyl 3,3'-(7,12-diethenyl-3,8,13,17-tetramethylporphyrin-2,18-diyl)dipropanoate|7,12-Diethenyl-3,8,13,17-tetramethyl-21H,23H-porphyrin-2,18-dipropionic acid diethyl ester|ethyl 3-[7,12-bis(ethenyl)-18-(3-ethoxy-3-oxopropyl)-3,8,13,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoate

CAS: 7403-58-9
Molecular Formula C38H42N4O4
Molecular Weight 618.3206 g/mol
LogP 6.0
Topological Polar Surface Area 110.0 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 12
Exact Mass 618.3206
Monoisotopic Mass 618.3206
Heavy Atoms 46
Complexity 1070.0

Chemical Identifiers

CAS Number 7403-58-9
SMILES CCOC(=O)CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=CC5=NC(=CC1=N2)C(=C5C)CCC(=O)OCC)N4)C=C)C)C=C)C)C
InChIKey FEOWTYCTNRBSSR-UHFFFAOYSA-N

Product Overview

Protoporphyrin IX diethyl (CAS 7403-58-9), with molecular formula C38H42N4O4 and molecular weight 618.3206 g/mol. IUPAC: ethyl 3-[8,13-bis(ethenyl)-18-(3-ethoxy-3-oxopropyl)-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoate.

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