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52864-48-9 | 2-(2-(pyridin-3-yl)ethyl)pyridine
CAS No: 52864-48-9 Catalog No: AG01E71Y MDL No:MFCD03731027
Product Description
Catalog Number:
AG01E71Y
Chemical Name:
2-(2-(pyridin-3-yl)ethyl)pyridine
CAS Number:
52864-48-9
Molecular Formula:
C12H12N2
Molecular Weight:
184.2371
MDL Number:
MFCD03731027
IUPAC Name:
2-(2-pyridin-3-ylethyl)pyridine
InChI:
InChI=1S/C12H12N2/c1-2-9-14-12(5-1)7-6-11-4-3-8-13-10-11/h1-5,8-10H,6-7H2
InChI Key:
FKRHNJKOAMFDOX-UHFFFAOYSA-N
SMILES:
c1ccc(nc1)CCc1cccnc1
NSC Number:
66162
Properties
Complexity:
158
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.1g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.242g/mol
Monoisotopic Mass:
184.1g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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