4'-Bromo-2,2':6',2''-terpyridine

Catalog Number	ACM149817629
CAS	149817-62-9
Structure
Synonyms	4'-Bromo-α,α',α''-tripyridyl
IUPAC Name	4-bromo-2,6-dipyridin-2-ylpyridine
Molecular Weight	312.164001941681
Molecular Formula	C15H10BrN3
Canonical SMILES	C1=CC=NC(=C1)C2=CC(=CC(=N2)C3=CC=CC=N3)Br
InChI	CJRRILXBSCRHKN-UHFFFAOYSA-N
InChI Key	InChI=1S/C15H10BrN3/c16-11-9-14(12-5-1-3-7-17-12)19-15(10-11)13-6-2-4-8-18-13/h1-10H
Boiling Point	422.3±40.0 °C(Predicted)
Melting Point	135-140 °C
Purity	98%
Appearance	Off-white crystal
Complexity	261
Covalently-Bonded Unit Count	1
Exact Mass	311.00581
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Monoisotopic Mass	311.00581
Rotatable Bond Count	2
Topological Polar Surface Area	38.7 Ų