96514-07-7 Purity
92.0%(HPLC)
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The molecular formula of TC 81 is C29H35ClFN3O6.
The molecular weight of TC 81 is 576.1 g/mol.
The synonyms of TC 81 are Palonidipine hydrochloride, Palonidipine.HCl, and 96515-74-1.
TC 81 was created on 2005-08-08 and last modified on 2023-12-30.
The IUPAC name of TC 81 is 5-O-[3-[benzyl(methyl)amino]-2,2-dimethylpropyl] 3-O-methyl 4-(2-fluoro-5-nitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate; hydrochloride.
The InChIKey of TC 81 is OQHXRVQARZHYGQ-UHFFFAOYSA-N.
The Canonical SMILES of TC 81 is CC1=C(C(C(=C(N1)C)C(=O)OCC(C)(C)CN(C)CC2=CC=CC=C2)C3=C(C=CC(=C3)[N+](=O)[O-])F)C(=O)OC.Cl.
The CAS number of TC 81 is 96515-74-1.
TC 81 has 2 hydrogen bond donor counts.
Yes, the compound is canonicalized for TC 81.