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Home > Pyridines > 101028-38-0
101028-38-0 | 2,2'-Bipyridine, 4,4'-bis(methylthio)-
CAS No: 101028-38-0 Catalog No: AG0003KF MDL No:
Product Description
Catalog Number:
AG0003KF
Chemical Name:
2,2'-Bipyridine, 4,4'-bis(methylthio)-
CAS Number:
101028-38-0
Molecular Formula:
C12H12N2S2
Molecular Weight:
248.3671
IUPAC Name:
4-methylsulfanyl-2-(4-methylsulfanylpyridin-2-yl)pyridine
InChI:
InChI=1S/C12H12N2S2/c1-15-9-3-5-13-11(7-9)12-8-10(16-2)4-6-14-12/h3-8H,1-2H3
InChI Key:
HIXBLLPECIUVCR-UHFFFAOYSA-N
SMILES:
CSc1ccnc(c1)c1nccc(c1)SC
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.044g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.362g/mol
Monoisotopic Mass:
248.044g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
76.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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