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Home > Pyridines > 114443-33-3
114443-33-3 | Ethanone, 2-(4-methylphenyl)-1-(4-pyridinyl)-
CAS No: 114443-33-3 Catalog No: AG000EDM MDL No:
Product Description
Catalog Number:
AG000EDM
Chemical Name:
Ethanone, 2-(4-methylphenyl)-1-(4-pyridinyl)-
CAS Number:
114443-33-3
Molecular Formula:
C14H13NO
Molecular Weight:
211.2591
IUPAC Name:
2-(4-methylphenyl)-1-pyridin-4-ylethanone
InChI:
InChI=1S/C14H13NO/c1-11-2-4-12(5-3-11)10-14(16)13-6-8-15-9-7-13/h2-9H,10H2,1H3
InChI Key:
LEUPUDZAOSJCNM-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)CC(=O)c1ccncc1
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.1g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.264g/mol
Monoisotopic Mass:
211.1g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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