AC1MIELO structure

AC1MIELO

2-amino-3-(1,3-dimethylbenzimidazol-3-ium-2-yl)-4,6,7-trimethyl-1-benzofuran-5-ol iodide

Also Known As: 1H-Benzimidazolium, 2-(2-amino-5-hydroxy-4,6,7-trimethyl-3-benzofuranyl)-1,3-dimethyl-, iodide|2-amino-3-(1,3-dimethylbenzimidazol-3-ium-2-yl)-4,6,7-trimethyl-1-benzofuran-5-ol iodide|3-(1,3-Dimethyl-1,3-dihydro-2H-benzimidazol-2-ylidene)-2-imino-4,6,7-trimethyl-2,3-dihydro-1-benzofuran-5-ol--hydrogen iodide (1/1)

CAS: 82191-93-3
Molecular Formula C20H22IN3O2
Molecular Weight 463.07568 g/mol
LogP 0.63306
Topological Polar Surface Area 68.2 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 3
Rotatable Bonds 1
Exact Mass 463.07568
Monoisotopic Mass 463.07568
Heavy Atoms 26
Complexity 1132.6797

Chemical Identifiers

CAS Number 82191-93-3
SMILES CC1=C(C2=C(C(=C1O)C)C(=C(O2)N)C3=[N+](C4=CC=CC=C4N3C)C)C.[I-]

Product Overview

AC1MIELO (CAS 82191-93-3), with molecular formula C20H22IN3O2 and molecular weight 463.07568 g/mol. IUPAC: 2-amino-3-(1,3-dimethylbenzimidazol-3-ium-2-yl)-4,6,7-trimethyl-1-benzofuran-5-ol iodide.

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