5-Methyl-1,10-phenanthroline

Catalog Number	ACM3002786-1
CAS	3002-78-6
Structure
Synonyms	1,10-Phenanthroline, 5-methyl-; 5-Methylphenanthroline
IUPAC Name	5-methyl-1,10-phenanthroline
Molecular Weight	194.23
Molecular Formula	C13H10N2
Canonical SMILES	CC1=CC2=C(C3=C1C=CC=N3)N=CC=C2
InChI	UJAQYOZROIFQHO-UHFFFAOYSA-N
InChI Key	InChI=1S/C13H10N2/c1-9-8-10-4-2-6-14-12(10)13-11(9)5-3-7-15-13/h2-8H,1H3
Melting Point	113-114 °C -lit.
Purity	98%+
Appearance	Light yellow to beige powder
EC Number	221-099-9
Exact Mass	194.084398327
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Monoisotopic Mass	194.084398327
Rotatable Bond Count	0
Topological Polar Surface Area	25.8 Ų