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79476-36-1 | 3,3'-(1H-Pyrazole-3,5-diyl)dipyridine
CAS No: 79476-36-1 Catalog No: AG01FNQZ MDL No:
Product Description
Catalog Number:
AG01FNQZ
Chemical Name:
3,3'-(1H-Pyrazole-3,5-diyl)dipyridine
CAS Number:
79476-36-1
Molecular Formula:
C13H10N4
Molecular Weight:
222.2453
IUPAC Name:
3-(3-pyridin-3-yl-1H-pyrazol-5-yl)pyridine
InChI:
InChI=1S/C13H10N4/c1-3-10(8-14-5-1)12-7-13(17-16-12)11-4-2-6-15-9-11/h1-9H,(H,16,17)
InChI Key:
YVTBIPNIMMAQLZ-UHFFFAOYSA-N
SMILES:
c1ccc(cn1)c1[nH]nc(c1)c1cccnc1
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.091g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
222.251g/mol
Monoisotopic Mass:
222.091g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Literature
| Title | Journal |
|---|---|
| From simple to complex: topological evolution and luminescence variation in a copper(I) pyridylpyrazolate system tuned via second ligating spacers. | Inorganic chemistry 20110919 |
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