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14548-30-2 | Methanone, (4-methylphenyl)-4-pyridinyl-
CAS No: 14548-30-2 Catalog No: AG001D34 MDL No:
Product Description
Catalog Number:
AG001D34
Chemical Name:
Methanone, (4-methylphenyl)-4-pyridinyl-
CAS Number:
14548-30-2
Molecular Formula:
C13H11NO
Molecular Weight:
197.2325
IUPAC Name:
(4-methylphenyl)-pyridin-4-ylmethanone
InChI:
InChI=1S/C13H11NO/c1-10-2-4-11(5-3-10)13(15)12-6-8-14-9-7-12/h2-9H,1H3
InChI Key:
BCMJOPYGJGOYJH-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C(=O)c1ccncc1
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.084g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.237g/mol
Monoisotopic Mass:
197.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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