Products 63450-66-8

CAS 63450-66-8 appears in our catalog under these names: 2-[6-(Acetylphenylamino)-1,3,5-hexatrienyl]-1,1-dimethyl-3-sulfobutyl-1h-benz[e]indoliuminnersalt, 95%, Indocyanine green Impurity 17, 2-(6-(Acetylphenylamino)-1,3,5-hexatrienyl)-1,1-dimethyl-3-sulfobutyl-1H-benz(e)indolium Inner Salt, >95% (HPLC). Offered by: Combi-blocks, Chemat Brand, TRC. Available pack sizes: 1g, 250mg, 100mg, on request.

2-[6-(Acetylphenylamino)-1,3,5-hexatrienyl]-1,1-dimethyl-3-sulfobutyl-1h-benz[e]indoliuminnersalt, 95%
Combi-blocks
  • size: 1g, 250mg, 100mg
  • Variants: 3
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Indocyanine green Impurity 17
Chemat Brand
  • size: on request
  • Variants: 1
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2-(6-(Acetylphenylamino)-1,3,5-hexatrienyl)-1,1-dimethyl-3-sulfobutyl-1H-benz(e)indolium Inner Salt, >95% (HPLC)
TRC
  • size: 100mg, 1g
  • Variants: 2
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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