5,5'-Bis(mercaptomethyl)-2,2'-bipyridine

Catalog Number	ACM894105987-2
CAS	894105-98-7
Synonyms	([2,2'-Bipyridine]-5,5'-diyl)dimethanethiol
IUPAC Name	[6-[5-(sulfanylmethyl)pyridin-2-yl]pyridin-3-yl]methanethiol
Molecular Weight	248.37
Molecular Formula	C12H12N2S2
InChI	InChI=1S/C12H12N2S2/c15-7-9-1-3-11(13-5-9)12-4-2-10(8-16)6-14-12/h1-6,15-16H,7-8H2
InChI Key	ZMDCFZNTOOSOBX-UHFFFAOYSA-N
Complexity	191
EC Number	686-970-1
Exact Mass	248.04419074 g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isomeric SMILES	C1=CC(=NC=C1CS)C2=NC=C(C=C2)CS
Monoisotopic Mass	248.04419074 g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	27.8Ų