Products 57704-66-2

CAS 57704-66-2 is the registry number for Malachite green picrate, ISO 17034 RM. Offered by: HPC Standards. Available pack sizes: 25mg.

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

[4-[[4-(dimethylamino)phenyl]-phenylmethylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium;2,4,6-trinitrophenolate (CAS 57704-66-2) is a chemical compound with the molecular formula C29H27N5O7 and a molecular weight of 557.6 g/mol. IUPAC name: [4-[[4-(dimethylamino)phenyl]-phenylmethylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium;2,4,6-trinitrophenolate. InChIKey: HKJSJDRORUIJJI-UHFFFAOYSA-M.

Identity
Molecular formulaC29H27N5O7
Molecular weight557.6 g/mol
IUPAC name[4-[[4-(dimethylamino)phenyl]-phenylmethylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium;2,4,6-trinitrophenolate
InChIKeyHKJSJDRORUIJJI-UHFFFAOYSA-M
SMILESCN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=CC=C3.C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-]

Computed by PubChem (NCBI)