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4'-(4-Bromophenyl)-2,2':6',2''-terpyridine

Catalog Number ACM89972769
CAS 89972-76-9
Structure 4'-(4-Bromophenyl)-2,2':6',2''-terpyridine
Synonyms 4-(4-Bromophenyl)-2,6-dipyridin-2-ylpyridine
IUPAC Name 4-(4-bromophenyl)-2,6-dipyridin-2-ylpyridine;
Molecular Weight 388.25
Molecular Formula C21H14BrN3
Canonical SMILES C1=CC=NC(=C1)C2=CC(=CC(=N2)C3=CC=CC=N3)C4=CC=C(C=C4)Br;
InChI InChI=1S/C21H14BrN3/c22-17-9-7-15(8-10-17)16-13-20(18-5-1-3-11-23-18)25-21(14-16)19-6-2-4-12-24-19/h1-14H;
InChI Key BOPPHKMZOYPASP-UHFFFAOYSA-N;
Purity 98%
Appearance White flocculent solid
Complexity 384
Covalently-Bonded Unit Count 1
Exact Mass 387.037g/mol
Heavy Atom Count 25
Monoisotopic Mass 387.037g/mol
Rotatable Bond Count 3
Topological Polar Surface Area 38.7A^2

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