2,9-Dioctadecylanthra[2,1,9-def:6,5,10-d'e'f′]diisoquinoline-1,3,8,10(2H,9H)-tetrone

CAS Registry Number®

25834-02-0

CAS Name

2,9-Dioctadecylanthra[2,1,9-def:6,5,10-d'e'f′]diisoquinoline-1,3,8,10(2H,9H)-tetrone

Molecular Formula

C60H82N2O4

Molecular Mass

895.30

Cite this Page

2,9-Dioctadecylanthra[2,1,9-def:6,5,10-d'e'f′]diisoquinoline-1,3,8,10(2H,9H)-tetrone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=25834-02-0 (retrieved 2024-11-23) (CAS RN: 25834-02-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    >360 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C60H82N2O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-43-61-57(63)49-39-35-45-47-37-41-51-56-52(42-38-48(54(47)56)46-36-40-50(58(61)64)55(49)53(45)46)60(66)62(59(51)65)44-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-42H,3-34,43-44H2,1-2H3

InChIKey

InChIKey=SPPVDEHBIATCNG-UHFFFAOYSA-N

SMILES

O=C1C=2C3=C4C(C=5C=6C(C4=CC2)=CC=C7C6C(=CC5)C(=O)N(CCCCCCCCCCCCCCCCCC)C7=O)=CC=C3C(=O)N1CCCCCCCCCCCCCCCCCC

Canonical SMILES

O=C1C2=CC=C3C4=CC=C5C(=O)N(C(=O)C6=CC=C(C=7C=CC(C(=O)N1CCCCCCCCCCCCCCCCCC)=C2C37)C4=C56)CCCCCCCCCCCCCCCCCC

Other Names for this Substance

  • Anthra[2,1,9-def:6,5,10-d'e'f′]diisoquinoline-1,3,8,10(2H,9H)-tetrone, 2,9-dioctadecyl-
  • 3,4,9,10-Perylenetetracarboxylic 3,4:9,10-diimide, N,N′-dioctadecyl-
  • 2,9-Dioctadecylanthra[2,1,9-def:6,5,10-d'e'f′]diisoquinoline-1,3,8,10(2H,9H)-tetrone
  • N,N′-Dioctadecyl-3,4,9,10-perylenetetracarboxylic diimide
  • N,N′-Bis(octadecyl)-3,4:9,10-perylenebis(dicarboximide)

Deleted or Replaced CAS Registry Numbers

153498-85-2

CAS INSIGHTSTM
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