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Home > Imidazoles > 86002-64-4
86002-64-4 | 4-(4,5-DIHYDRO-1-ETHYL-5-PHENYL-1H-IMIDAZOL-2-YL)PYRIDINE
CAS No: 86002-64-4 Catalog No: AG004Q2K MDL No:
Product Description
Catalog Number:
AG004Q2K
Chemical Name:
4-(4,5-DIHYDRO-1-ETHYL-5-PHENYL-1H-IMIDAZOL-2-YL)PYRIDINE
CAS Number:
86002-64-4
Molecular Formula:
C16H17N3
Molecular Weight:
251.3263
IUPAC Name:
4-(1-ethyl-5-phenyl-4,5-dihydroimidazol-2-yl)pyridine
InChI:
InChI=1S/C16H17N3/c1-2-19-15(13-6-4-3-5-7-13)12-18-16(19)14-8-10-17-11-9-14/h3-11,15H,2,12H2,1H3
InChI Key:
PDSMGQPHKSYHJY-UHFFFAOYSA-N
SMILES:
CCN1C(CN=C1c1ccncc1)c1ccccc1
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.142g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.333g/mol
Monoisotopic Mass:
251.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
28.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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