5,10,15,20-Tetrakis(4-nitrophenyl)porphyrin

Name: 5,10,15,20-Tetrakis(4-nitrophenyl)porphyrin
SKU: ACM22843738-3
Rating: 5 (1 reviews)

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Catalog NumberACM22843738-3

CAS Number22843-73-8

CategoryPorphyrin-A4-porphyrin

5,10,15,20-Tetrakis(4-nitrophenyl)porphyrin

Synonyms

Tetra(p-nitrophenyl)porphyrin; 5,10,15,20-tetrakis(4-nitrophenyl)-21,22-dihydroporphyrin

IUPAC Name

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

Molecular Weight

794.73

Molecular Formula

C44H26N8O8

InChI

FVHZCBQLLFLQAG-UHFFFAOYSA-N

InChI Key

InChI=1S/C44H26N8O8/c53-49(54)29-9-1-25(2-10-29)41-33-17-19-35(45-33)42(26-3-11-30(12-4-26)50(55)56)37-21-23-39(47-37)44(28-7-15-32(16-8-28)52(59)60)40-24-22-38(48-40)43(36-20-18-34(41)46-36)27-5-13-31(14-6-27)51(57)58/h1-24,45,48H

Boiling Point

>27 °C

Melting Point

>27 °C

Purity

95%

Appearance

Purple solid

Complexity

1300

Compound Is Canonicalized

Yes

Covalently-Bonded Unit Count

Defined Atom Stereocenter Count

Defined Bond Stereocenter Count

Exact Mass

794.18735982g/mol

Formal Charge

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

Isomeric SMILES

C1=CC(=CC=C1C2=C3C=CC(=C(C4=NC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)[N+](=O)[O-])C8=CC=C(C=C8)[N+](=O)[O-])C=C4)C9=CC=C(C=C9)[N+](=O)[O-])N3)[N+](=O)[O-]

Isotope Atom Count

Monoisotopic Mass

794.18735982g/mol

Rotatable Bond Count

Topological Polar Surface Area

241Å²

Undefined Atom Stereocenter Count

Undefined Bond Stereocenter Count

XLogP3

9.7

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