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Home > Pyridines > 101028-40-4
101028-40-4 | [2,2'-Bipyridine]-4,4'(1H,1'H)-dithione
CAS No: 101028-40-4 Catalog No: AG0003KE MDL No:
Product Description
Catalog Number:
AG0003KE
Chemical Name:
[2,2'-Bipyridine]-4,4'(1H,1'H)-dithione
CAS Number:
101028-40-4
Molecular Formula:
C10H8N2S2
Molecular Weight:
220.3139
IUPAC Name:
2-(4-sulfanylidene-1H-pyridin-2-yl)-1H-pyridine-4-thione
InChI:
InChI=1S/C10H8N2S2/c13-7-1-3-11-9(5-7)10-6-8(14)2-4-12-10/h1-6H,(H,11,13)(H,12,14)
InChI Key:
LVGFTBGCXCYEFM-UHFFFAOYSA-N
SMILES:
S=c1cc[nH]c(c1)c1[nH]ccc(=S)c1
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.013g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
220.308g/mol
Monoisotopic Mass:
220.013g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
88.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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