Deuteroporphyrin

CAS Registry Number®

448-65-7
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CAS Name

Deuteroporphyrin

Molecular Formula

C30H30N4O4

Molecular Mass

510.58

Cite this Page

Deuteroporphyrin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=448-65-7 (retrieved 2024-05-17) (CAS RN: 448-65-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    >250 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C30H30N4O4/c1-15-9-20-12-25-17(3)21(5-7-29(35)36)27(33-25)14-28-22(6-8-30(37)38)18(4)26(34-28)13-24-16(2)10-19(32-24)11-23(15)31-20/h9-14,31,34H,5-8H2,1-4H3,(H,35,36)(H,37,38)/b19-11-,20-12?,23-11?,24-13?,25-12-,26-13-,27-14?,28-14-

InChIKey

InChIKey=KWKUIRGQJJFUCG-BTLQVSHBSA-N

SMILES

C(CC(O)=O)C1=C2C=C3C(CCC(O)=O)=C(C)C(=N3)C=C4NC(=CC5=NC(=CC(N2)=C1C)C(C)=C5)C(C)=C4

Canonical SMILES

O=C(O)CCC=1C=2N=C(C=C3C=C(C(=CC4=NC(=CC=5NC(C2)=C(C5C)CCC(=O)O)C(=C4)C)N3)C)C1C

Other Names for this Substance

  • 21H,23H-Porphine-2,18-dipropanoic acid, 3,7,12,17-tetramethyl-
  • Deuteroporphyrin IX
  • 2,18-Porphinedipropionic acid, 3,7,12,17-tetramethyl-
  • 3,7,12,17-Tetramethyl-21H,23H-porphine-2,18-dipropanoic acid
  • Deuteroporphyrin

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Deleted or Replaced CAS Registry Numbers

5522-68-9, 112635-91-3, 191342-59-3, 200862-82-4, 374700-51-3, 1186319-10-7, 1235571-88-6, 1442523-48-9

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