Products 78617-94-4

CAS 78617-94-4 appears in our catalog under these names: Blue FPG-A, Blue FPG-A (trisodium). Offered by: TRC, Biosynth, MedChemExpress. Available pack sizes: 100mg, 25mg, 50mg, Get quote.

Blue FPG-A
TRC, Biosynth
  • size: 100mg, 25mg, 50mg
  • Variants: 4
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Blue FPG-A (trisodium)
MedChemExpress
  • size: Get quote
  • Variants: 1
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Structural formula: {0} (CAS {1})

Trisodium;1-amino-4-[4-[[4-chloro-6-(4-sulfonatoanilino)-1,3,5-triazin-2-yl]amino]-3-sulfonatoanilino]-9,10-dioxoanthracene-2-sulfonate (CAS 78617-94-4) is a chemical compound with the molecular formula C29H17ClN7Na3O11S3 and a molecular weight of 840.1 g/mol. IUPAC name: trisodium;1-amino-4-[4-[[4-chloro-6-(4-sulfonatoanilino)-1,3,5-triazin-2-yl]amino]-3-sulfonatoanilino]-9,10-dioxoanthracene-2-sulfonate. InChIKey: WDPGNDHCHKUGLY-UHFFFAOYSA-K.

Identity
Molecular formulaC29H17ClN7Na3O11S3
Molecular weight840.1 g/mol
IUPAC nametrisodium;1-amino-4-[4-[[4-chloro-6-(4-sulfonatoanilino)-1,3,5-triazin-2-yl]amino]-3-sulfonatoanilino]-9,10-dioxoanthracene-2-sulfonate
InChIKeyWDPGNDHCHKUGLY-UHFFFAOYSA-K
SMILESC1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=C(C=C6)S(=O)(=O)[O-])Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+].[Na+]

Computed by PubChem (NCBI)

Synonyms: Blue FPG-A, Blue FPG-A trisodium, Basilen Blue E-3G, Lopac-R-115, orb1982084, Tox21_501054
Isomers (same molecular formula)
trisodium;1-amino-4-[4-[[4-chloro-6-(2-sulfonatoanilino)-1,3,5-triazin-2-yl]amino]-3-sulfonatoanilino]-9,10-dioxoanthracene-2-sulfonate C29H17ClN7Na3O11S3