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Home > Pyridines > 130897-01-7
130897-01-7 | 2,2'-Bipyridine, 6-(ethylthio)-
CAS No: 130897-01-7 Catalog No: AG000V2P MDL No:
Product Description
Catalog Number:
AG000V2P
Chemical Name:
2,2'-Bipyridine, 6-(ethylthio)-
CAS Number:
130897-01-7
Molecular Formula:
C12H12N2S
Molecular Weight:
216.3021
IUPAC Name:
2-ethylsulfanyl-6-pyridin-2-ylpyridine
InChI:
InChI=1S/C12H12N2S/c1-2-15-12-8-5-7-11(14-12)10-6-3-4-9-13-10/h3-9H,2H2,1H3
InChI Key:
PYTAHXAHIXLUCM-UHFFFAOYSA-N
SMILES:
CCSc1cccc(n1)c1ccccn1
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.072g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.302g/mol
Monoisotopic Mass:
216.072g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
51.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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