Products 1258668-21-1

CAS 1258668-21-1 appears in our catalog under these names: Malachite green D5 picrate, Malachite green D5 picrate 100 µg/mL in Acetone, BIS-(4-DIMETHYLAMINO-PHENYL)-PHENYL-D5-CARBENIUM PICRATE, 95%, 95%, Malachite green-d5 (picrate), D5-Malachite green picrate. Offered by: Dr. Ehrenstorfer, Chemat, MedChemExpress, HPC Standards. Available pack sizes: 10mg, 1ml, 5 mg, 1 mg, 10 mg, 1x10mg.

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

[4-[[4-(dimethylamino)phenyl]-(2,3,4,5,6-pentadeuteriophenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium;2,4,6-trinitrophenolate (CAS 1258668-21-1) is a chemical compound with the molecular formula C29H27N5O7 and a molecular weight of 562.6 g/mol. IUPAC name: [4-[[4-(dimethylamino)phenyl]-(2,3,4,5,6-pentadeuteriophenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium;2,4,6-trinitrophenolate. InChIKey: HKJSJDRORUIJJI-AYVDECCJSA-M.

Identity
Molecular formulaC29H27N5O7
Molecular weight562.6 g/mol
IUPAC name[4-[[4-(dimethylamino)phenyl]-(2,3,4,5,6-pentadeuteriophenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium;2,4,6-trinitrophenolate
InChIKeyHKJSJDRORUIJJI-AYVDECCJSA-M
SMILES[2H]C1=C(C(=C(C(=C1[2H])[2H])C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C)[2H])[2H].C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-]

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