Products 400856-69-1

CAS 400856-69-1 is the registry number for AC-41848 hydrate >= 98 % HPLC, solid. Offered by: Sigma-Aldrich. Available pack sizes: 20MG.

AC-41848 hydrate >= 98 % HPLC, solid
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  • size: 20MG
  • Variants: 1
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Structural formula: {0} (CAS {1})

1-[(2,4-dichlorophenyl)methyl]-3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-1-ium bromide (CAS 400856-69-1) is a chemical compound with the molecular formula C21H21BrCl2N2 and a molecular weight of 452.2 g/mol. IUPAC name: 1-[(2,4-dichlorophenyl)methyl]-3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-1-ium bromide. InChIKey: MONZVJQEZDDRBA-UHFFFAOYSA-M.

Identity
Molecular formulaC21H21BrCl2N2
Molecular weight452.2 g/mol
IUPAC name1-[(2,4-dichlorophenyl)methyl]-3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-1-ium bromide
InChIKeyMONZVJQEZDDRBA-UHFFFAOYSA-M
SMILESC1CCC2=[N+](C=C(N2CC1)C3=CC=CC=C3)CC4=C(C=C(C=C4)Cl)Cl.[Br-]

Computed by PubChem (NCBI)

Synonyms: MONZVJQEZDDRBA-UHFFFAOYSA-M, REGID_for_CID_11568649