Indocyanine green Impurity 17

cas: 63450-66-8 — see every product listed under this CAS number, including other names

Indocyanine green Impurity 17 (CAS 63450-66-8) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberRM-I301017
cas63450-66-8
sizeon request

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Structural formula: {0} (CAS {1})

4-[2-[(1E,3E,5E)-6-(N-acetylanilino)hexa-1,3,5-trienyl]-1,1-dimethylbenzo[e]indol-3-ium-3-yl]butane-1-sulfonate (CAS 63450-66-8) is a chemical compound with the molecular formula C32H34N2O4S and a molecular weight of 542.7 g/mol. IUPAC name: 4-[2-[(1E,3E,5E)-6-(N-acetylanilino)hexa-1,3,5-trienyl]-1,1-dimethylbenzo[e]indol-3-ium-3-yl]butane-1-sulfonate. InChIKey: BIRXJKJWUZPHPJ-UHFFFAOYSA-N.

Identity
Molecular formulaC32H34N2O4S
Molecular weight542.7 g/mol
IUPAC name4-[2-[(1E,3E,5E)-6-(N-acetylanilino)hexa-1,3,5-trienyl]-1,1-dimethylbenzo[e]indol-3-ium-3-yl]butane-1-sulfonate
InChIKeyBIRXJKJWUZPHPJ-UHFFFAOYSA-N
SMILESCC(=O)N(/C=C/C=C/C=C/C1=[N+](C2=C(C1(C)C)C3=CC=CC=C3C=C2)CCCCS(=O)(=O)[O-])C4=CC=CC=C4

Computed by PubChem (NCBI)

Synonyms: Indocyanine Green Impurity 15

Also listed as

2-[6-(Acetylphenylamino)-1,3,5-hexatrienyl]-1,1-dimethyl-3-sulfobutyl-1h-benz[e]indoliuminnersalt, 95% Combi-blocks CAS 63450-66-8
2-(6-(Acetylphenylamino)-1,3,5-hexatrienyl)-1,1-dimethyl-3-sulfobutyl-1H-benz(e)indolium Inner Salt, >95% (HPLC) TRC CAS 63450-66-8