2,18-Dimethyl 7,12-diethenyl-3,8,13,17-tetramethyl-21H,23H-porphine-2,18-dipropanoate

CAS Registry Number®

5522-66-7
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CAS Name

2,18-Dimethyl 7,12-diethenyl-3,8,13,17-tetramethyl-21H,23H-porphine-2,18-dipropanoate

Molecular Formula

C36H38N4O4

Molecular Mass

590.71

Cite this Page

2,18-Dimethyl 7,12-diethenyl-3,8,13,17-tetramethyl-21H,23H-porphine-2,18-dipropanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=5522-66-7 (retrieved 2024-05-03) (CAS RN: 5522-66-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    228-230 °C

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1S/C36H38N4O4/c1-9-23-19(3)27-15-28-21(5)25(11-13-35(41)43-7)33(39-28)18-34-26(12-14-36(42)44-8)22(6)30(40-34)17-32-24(10-2)20(4)29(38-32)16-31(23)37-27/h9-10,15-18,37,40H,1-2,11-14H2,3-8H3/b27-15?,28-15-,29-16-,30-17-,31-16?,32-17?,33-18?,34-18-

InChIKey

InChIKey=WASRLAPXOHTNAX-ZYXFLHOESA-N

SMILES

C(CC(OC)=O)C1=C2C=C3C(CCC(OC)=O)=C(C)C(=N3)C=C4NC(=CC5=NC(=CC(N2)=C1C)C(C=C)=C5C)C(C=C)=C4C

Canonical SMILES

O=C(OC)CCC=1C=2N=C(C=C3NC(=CC4=NC(=CC=5NC(C2)=C(C5C)CCC(=O)OC)C(C=C)=C4C)C(C=C)=C3C)C1C

Other Names for this Substance

  • 21H,23H-Porphine-2,18-dipropanoic acid, 7,12-diethenyl-3,8,13,17-tetramethyl-, 2,18-dimethyl ester
  • 2,18-Porphinedipropionic acid, 3,7,12,17-tetramethyl-8,13-divinyl-, dimethyl ester
  • 21H,23H-Porphine-2,18-dipropanoic acid, 7,12-diethenyl-3,8,13,17-tetramethyl-, dimethyl ester
  • Protoporphyrin IX di-Me ester
  • Protoporphyrin dimethyl ester

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Deleted or Replaced CAS Registry Numbers

6164-53-0, 14399-13-4, 43113-71-9, 64194-56-5, 64613-78-1, 68079-02-7, 75460-43-4, 96251-63-7, 250230-45-6, 412320-56-0, 1082666-90-7

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