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Home > Pyridines > 252198-96-2
252198-96-2 | Ethanone, 1-(4-cyclohexylphenyl)-2-(4-pyridinyl)-
CAS No: 252198-96-2 Catalog No: AG002QYG MDL No:
Product Description
Catalog Number:
AG002QYG
Chemical Name:
Ethanone, 1-(4-cyclohexylphenyl)-2-(4-pyridinyl)-
CAS Number:
252198-96-2
Molecular Formula:
C19H21NO
Molecular Weight:
279.3761
IUPAC Name:
1-(4-cyclohexylphenyl)-2-pyridin-4-ylethanone
InChI:
InChI=1S/C19H21NO/c21-19(14-15-10-12-20-13-11-15)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h6-13,16H,1-5,14H2
InChI Key:
IEXOEWSIWACRSN-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)C1CCCCC1)Cc1ccncc1
Properties
Complexity:
321
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.162g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.383g/mol
Monoisotopic Mass:
279.162g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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