Products 1246816-93-2

CAS 1246816-93-2 appears in our catalog under these names: Tolcapone-d4, Tolcapone-d4, >95% (HPLC), Tolcapone–d4, Tolcapone-d4, 99.13%. Offered by: Chemat Brand, TRC, GLPBio, MedChemExpress. Available pack sizes: on request, 10mg, 1mg, 1 mg.

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

(3,4-dihydroxy-5-nitrophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)methanone (CAS 1246816-93-2) is a chemical compound with the molecular formula C14H11NO5 and a molecular weight of 277.26 g/mol. IUPAC name: (3,4-dihydroxy-5-nitrophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)methanone. InChIKey: MIQPIUSUKVNLNT-QFFDRWTDSA-N.

Identity
Molecular formulaC14H11NO5
Molecular weight277.26 g/mol
IUPAC name(3,4-dihydroxy-5-nitrophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)methanone
InChIKeyMIQPIUSUKVNLNT-QFFDRWTDSA-N
SMILES[2H]C1=C(C(=C(C(=C1C)[2H])[2H])C(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-])[2H]

Computed by PubChem (NCBI)