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Home > Imidazoles > 113464-46-3
113464-46-3 | Pyridine, 2-(1-octyl-1H-imidazol-2-yl)-
CAS No: 113464-46-3 Catalog No: AG0008O2 MDL No:
Product Description
Catalog Number:
AG0008O2
Chemical Name:
Pyridine, 2-(1-octyl-1H-imidazol-2-yl)-
CAS Number:
113464-46-3
Molecular Formula:
C16H23N3
Molecular Weight:
257.3739
IUPAC Name:
2-(1-octylimidazol-2-yl)pyridine
InChI:
InChI=1S/C16H23N3/c1-2-3-4-5-6-9-13-19-14-12-18-16(19)15-10-7-8-11-17-15/h7-8,10-12,14H,2-6,9,13H2,1H3
InChI Key:
QUKZJPOUIOGEBW-UHFFFAOYSA-N
SMILES:
CCCCCCCCn1ccnc1c1ccccn1
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.189g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.381g/mol
Monoisotopic Mass:
257.189g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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