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Home > Pyridines > 138456-34-5
138456-34-5 | 2,2'-Bipyridine, 6'-(1-buten-1-yl)-5-(1-methylethyl)-
CAS No: 138456-34-5 Catalog No: AG00197A MDL No:
Product Description
Catalog Number:
AG00197A
Chemical Name:
2,2'-Bipyridine, 6'-(1-buten-1-yl)-5-(1-methylethyl)-
CAS Number:
138456-34-5
Molecular Formula:
C17H20N2
Molecular Weight:
252.3541
IUPAC Name:
2-but-1-enyl-6-(5-propan-2-ylpyridin-2-yl)pyridine
InChI:
InChI=1S/C17H20N2/c1-4-5-7-15-8-6-9-17(19-15)16-11-10-14(12-18-16)13(2)3/h5-13H,4H2,1-3H3
InChI Key:
KATVJDAPBOLNNA-UHFFFAOYSA-N
SMILES:
CCC=Cc1cccc(n1)c1ccc(cn1)C(C)C
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.163g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.361g/mol
Monoisotopic Mass:
252.163g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.1
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