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308847-53-2 | Pyridine, 2-(phenyldi-1H-pyrazol-1-ylmethyl)-
CAS No: 308847-53-2 Catalog No: AG0031L2 MDL No:
Product Description
Catalog Number:
AG0031L2
Chemical Name:
Pyridine, 2-(phenyldi-1H-pyrazol-1-ylmethyl)-
CAS Number:
308847-53-2
Molecular Formula:
C18H15N5
Molecular Weight:
301.3452
IUPAC Name:
2-[phenyl-di(pyrazol-1-yl)methyl]pyridine
InChI:
InChI=1S/C18H15N5/c1-2-8-16(9-3-1)18(22-14-6-12-20-22,23-15-7-13-21-23)17-10-4-5-11-19-17/h1-15H
InChI Key:
RUEDRZZJVRLZJS-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C(n1cccn1)(n1cccn1)c1ccccn1
Properties
Complexity:
366
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.133g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.353g/mol
Monoisotopic Mass:
301.133g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
48.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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