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15827-72-2 | Pyridine, 2,5-diphenyl-
CAS No: 15827-72-2 Catalog No: AG001Q3K MDL No:MFCD00444961
Product Description
Catalog Number:
AG001Q3K
Chemical Name:
Pyridine, 2,5-diphenyl-
CAS Number:
15827-72-2
Molecular Formula:
C17H13N
Molecular Weight:
231.2918
MDL Number:
MFCD00444961
IUPAC Name:
2,5-diphenylpyridine
InChI:
InChI=1S/C17H13N/c1-3-7-14(8-4-1)16-11-12-17(18-13-16)15-9-5-2-6-10-15/h1-13H
InChI Key:
MOSQXYPUMBJMRR-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1ccc(cn1)c1ccccc1
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.105g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.298g/mol
Monoisotopic Mass:
231.105g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
Literature
| Title | Journal |
|---|---|
| Energetic and structural study of diphenylpyridine isomers. | The journal of physical chemistry. A 20091015 |
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