Chemical Compound

IR-806

CAS Registry Number 757960-10-4
Back to search Request a Quote
IR-806 chemical structure
Primary Record

IR-806

In stock
8,040 g
Purity
99.2 %
CAS
757960-10-4

Compound Identifiers & Properties

CAS
757960-10-4
PubChem CID
132968179
SMILES
CC1(C2=CC=CC=C2[N+](=C1C=CC3=C(C(=CC=C4C(C5=CC=CC=C5N4CCCCS(=O)(=O)[O-])(C)C)CC3)Cl)CCCCS(=O)(=O)[O-])C.[Na+]
Canonical SMILES
CC1(C)C(=CC=C2CCC(C=CC3=[N+](CCCCS(=O)(=O)[O-])c4ccccc4C3(C)C)=C2Cl)N(CCCCS(=O)(=O)[O-])c2ccccc21.[Na+]

Names & Synonyms

  • IR-806
  • FI182321
  • 757960-10-4
  • 2-[2-[2-Chloro-3-[2-[1,3-dihydro-3,3-dimethyl-1-(4-sulfobutyl)-2H-indol-2-ylidene]ethylidene]-1-cyclopenten-1-yl]ethenyl]-3,3-dimethyl-1-(4-sulfobutyl)-3H-indolium inner salt sodium salt