Thiocyanic acid, C,C′-[(1,3,8,10-tetrahydro-1,3,8,10-tetraoxoanthra[2,1,9-def:6,5,10-d'e'f′]diisoquinoline-2,9-diyl)di-3,1-phenylene] ester

CAS Registry Number®

67923-45-9

CAS Name

Thiocyanic acid, C,C′-[(1,3,8,10-tetrahydro-1,3,8,10-tetraoxoanthra[2,1,9-def:6,5,10-d'e'f′]diisoquinoline-2,9-diyl)di-3,1-phenylene] ester

Molecular Formula

C38H16N4O4S2

Molecular Mass

656.69

Cite this Page

Thiocyanic acid, C,C′-[(1,3,8,10-tetrahydro-1,3,8,10-tetraoxoanthra[2,1,9-def:6,5,10-d'e'f′]diisoquinoline-2,9-diyl)di-3,1-phenylene] ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=81209-07-6 (retrieved 2025-03-12) (CAS RN: 67923-45-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C38H16N4O4S2/c39-17-47-21-5-1-3-19(15-21)41-35(43)27-11-7-23-25-9-13-29-34-30(38(46)42(37(29)45)20-4-2-6-22(16-20)48-18-40)14-10-26(32(25)34)24-8-12-28(36(41)44)33(27)31(23)24/h1-16H

InChIKey

InChIKey=AXMXHZAKIVTXGG-UHFFFAOYSA-N

SMILES

O=C1C=2C3=C4C(C=5C=6C(C4=CC2)=CC=C7C6C(=CC5)C(=O)N(C7=O)C8=CC(SC#N)=CC=C8)=CC=C3C(=O)N1C9=CC(SC#N)=CC=C9

Canonical SMILES

N#CSC1=CC=CC(=C1)N2C(=O)C3=CC=C4C5=CC=C6C(=O)N(C(=O)C7=CC=C(C=8C=CC(C2=O)=C3C48)C5=C67)C=9C=CC=C(SC#N)C9

Other Names for this Substance

  • Thiocyanic acid, C,C′-[(1,3,8,10-tetrahydro-1,3,8,10-tetraoxoanthra[2,1,9-def:6,5,10-d'e'f′]diisoquinoline-2,9-diyl)di-3,1-phenylene] ester
  • Thiocyanic acid, (1,3,8,10-tetrahydro-1,3,8,10-tetraoxoanthra[2,1,9-def:6,5,10-d'e'f′]diisoquinoline-2,9-diyl)di-3,1-phenylene ester
  • Anthra[2,1,9-def:6,5,10-d'e'f′]diisoquinoline, thiocyanic acid deriv.
  • C.I. Sulphur Red 11
  • Immedial Red 2G

View All

Deleted or Replaced CAS Registry Numbers

81209-07-6

CAS INSIGHTSTM
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