CAS 22112-78-3 5,10,15,20-Tetrakis(4-methoxyphenyl)-21h,23h-porphine

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5,10,15,20-Tetrakis(4-methoxyphenyl)-21h,23h-porphine

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Catalog Number

ACM22112783-5

CAS Number

22112-78-3

Product Name

5,10,15,20-Tetrakis(4-methoxyphenyl)-21h,23h-porphine

Structure

Category

Other Materials

Synonyms

5,10,15,20-Tetrakis(4-methoxyphenyl)porphyrin; Tetra(p-methoxyphenyl)porphyrin

IUPAC Name

5,10,15,20-tetrakis(4-methoxyphenyl)-21,23-dihydroporphyrin

Molecular Weight

734.84

Molecular Formula

C48H38N4O4

Canonical SMILES

COC1=CC=C(C=C1)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)OC)C8=CC=C(C=C8)OC)C=C4)C9=CC=C(C=C9)OC)N3

InChI

PJOJZHHAECOAFH-UHFFFAOYSA-N

InChI Key

InChI=1S/C48H38N4O4/c1-53-33-13-5-29(6-14-33)45-37-21-23-39(49-37)46(30-7-15-34(54-2)16-8-30)41-25-27-43(51-41)48(32-11-19-36(56-4)20-12-32)44-28-26-42(52-44)47(40-24-22-38(45)50-40)31-9-17-35(55-3)18-10-31/h5-28,49,52H,1-4H3

Melting Point

>27 °C

Purity

98%

Complexity

1030

Covalently-Bonded Unit Count

Exact Mass

734.28930571

Formal Charge

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

MeSH Entry Terms

5,10,15,20-tetrakis(4-methoxyphenyl)porphyrin;5,10,15,20-TMPP

Monoisotopic Mass

734.28930571

NSC Number

241210

Rotatable Bond Count

Topological Polar Surface Area

94.3 Å²

XLogP3

10.3

MSDS

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COA

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Spec Sheet

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