CAS 14409-63-3 2 3 7 8 12 13 17 18-Octaethyl-21h 23h-

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2 3 7 8 12 13 17 18-Octaethyl-21h 23h-

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Catalog Number

ACM14409633

Product Name

2 3 7 8 12 13 17 18-Octaethyl-21h 23h-

Structure

CAS

14409-63-3

Category

Other Materials

Synonyms

Copper octaethylporphyrin;Cu-OEP complex;2 3 7 8 12 13 17 18-OCTAETHYL-21H 23H-;2,3,7,8,12,13,17,18-OCTAETHYL-21H,23H-PO RPHINE COPPER(II), SYNTHETIC;((2,3,7,8,12,13,17,18)-octaethylporphinato)copper (II);Cu(II) Octaethylporphine;2,3,7,8,12,13,17,18-Octae

IUPAC Name

copper;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide

Molecular Weight

596.3g/mol

Molecular Formula

C36H44CuN4

Canonical SMILES

CCC1=C(C2=CC3=NC(=CC4=C(C(=C([N-]4)C=C5C(=C(C(=N5)C=C1[N-]2)CC)CC)CC)CC)C(=C3CC)CC)CC.[Cu+2]

InChI

InChI=1S/C36H44N4.Cu/c1-9-21-22(10-2)30-18-32-25(13-5)26(14-6)34(39-32)20-36-28(16-8)27(15-7)35(40-36)19-33-24(12-4)23(11-3)31(38-33)17-29(21)37-30;/h17-20H,9-16H2,1-8H3;/q-2;+2

InChI Key

WYWUPEFEFRBNGN-UHFFFAOYSA-N

Complexity

1150

Covalently-Bonded Unit Count

Exact Mass

595.286195g/mol

Formal Charge

Heavy Atom Count

MeSH Entry Terms

((2,3,7,8,12,13,17,18)-octaethylporphinato)copper (II);2-OEP-Cu

Monoisotopic Mass