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1269291-28-2 | Pyridine, 4-[1-(4-methylphenyl)-1H-pyrazol-5-yl]-
CAS No: 1269291-28-2 Catalog No: AG000TI5 MDL No:MFCD20275486
Product Description
Catalog Number:
AG000TI5
Chemical Name:
Pyridine, 4-[1-(4-methylphenyl)-1H-pyrazol-5-yl]-
CAS Number:
1269291-28-2
Molecular Formula:
C15H13N3
Molecular Weight:
235.2838
MDL Number:
MFCD20275486
IUPAC Name:
4-[2-(4-methylphenyl)pyrazol-3-yl]pyridine
InChI:
InChI=1S/C15H13N3/c1-12-2-4-14(5-3-12)18-15(8-11-17-18)13-6-9-16-10-7-13/h2-11H,1H3
InChI Key:
LJAVXEACZNSRFJ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)n1nccc1c1ccncc1
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.111g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.29g/mol
Monoisotopic Mass:
235.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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