5-Amino-8-bromo-9,10-dihydro-9,10-dioxo-1,6-anthracenedisulfonic acid

CAS Registry Number®

117-13-5
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CAS Name

5-Amino-8-bromo-9,10-dihydro-9,10-dioxo-1,6-anthracenedisulfonic acid

Molecular Formula

C14H8BrNO8S2

Molecular Mass

462.25

Cite this Page

5-Amino-8-bromo-9,10-dihydro-9,10-dioxo-1,6-anthracenedisulfonic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=117-13-5 (retrieved 2024-06-24) (CAS RN: 117-13-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H8BrNO8S2/c15-6-4-8(26(22,23)24)12(16)11-10(6)14(18)9-5(13(11)17)2-1-3-7(9)25(19,20)21/h1-4H,16H2,(H,19,20,21)(H,22,23,24)

InChIKey

InChIKey=OEBFYWPAABOJCP-UHFFFAOYSA-N

SMILES

S(=O)(=O)(O)C1=C2C(C(=O)C=3C(C2=O)=C(Br)C=C(S(=O)(=O)O)C3N)=CC=C1

Canonical SMILES

O=C1C2=CC=CC(=C2C(=O)C3=C(Br)C=C(C(N)=C13)S(=O)(=O)O)S(=O)(=O)O

Other Names for this Substance

  • 1,6-Anthracenedisulfonic acid, 5-amino-8-bromo-9,10-dihydro-9,10-dioxo-
  • 5-Amino-8-bromo-9,10-dihydro-9,10-dioxo-1,6-anthracenedisulfonic acid

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