Tetraphenylporphyrin

CAS Registry Number®

917-23-7
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CAS Name

Tetraphenylporphyrin

Molecular Formula

C44H30N4

Molecular Mass

614.74

Cite this Page

Tetraphenylporphyrin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=20998-75-8 (retrieved 2024-04-23) (CAS RN: 917-23-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    444 °C

  • Density (2)

    1.64 g/cm³

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C44H30N4/c1-5-13-29(14-6-1)41-33-21-23-35(45-33)42(30-15-7-2-8-16-30)37-25-27-39(47-37)44(32-19-11-4-12-20-32)40-28-26-38(48-40)43(31-17-9-3-10-18-31)36-24-22-34(41)46-36/h1-28,45,48H/b41-33-,41-34?,42-35-,42-37?,43-36-,43-38?,44-39-,44-40?

InChIKey

InChIKey=YNHJECZULSZAQK-VQHGFYMWSA-N

SMILES

C=1(C=2NC(=CC2)C(=C3N=C(C=C3)C(=C4NC(=C(C5=NC1C=C5)C6=CC=CC=C6)C=C4)C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9

Canonical SMILES

N1=C2C=CC1=C(C=3C=CC=CC3)C4=CC=C(N4)C(=C5N=C(C=C5)C(C=6C=CC=CC6)=C7C=CC(N7)=C2C=8C=CC=CC8)C=9C=CC=CC9

Other Names for this Substance

  • 21H,23H-Porphine, 5,10,15,20-tetraphenyl-
  • Porphine, 5,10,15,20-tetraphenyl-
  • Porphine, α,β,γ,δ-tetraphenyl-
  • 5,10,15,20-Tetraphenyl-21H,23H-porphine
  • α,β,γ,δ-Tetraphenylporphine

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Deleted or Replaced CAS Registry Numbers

106051-94-9, 15503-35-2, 20998-75-8, 25323-25-5, 87719-36-6

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