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88467-86-1 | Ethanone, 1-(2-methoxy-5-methylphenyl)-2-(2-pyridinyl)-
CAS No: 88467-86-1 Catalog No: AG004ADL MDL No:
Product Description
Catalog Number:
AG004ADL
Chemical Name:
Ethanone, 1-(2-methoxy-5-methylphenyl)-2-(2-pyridinyl)-
CAS Number:
88467-86-1
Molecular Formula:
C15H15NO2
Molecular Weight:
241.2851
IUPAC Name:
1-(2-methoxy-5-methylphenyl)-2-pyridin-2-ylethanone
InChI:
InChI=1S/C15H15NO2/c1-11-6-7-15(18-2)13(9-11)14(17)10-12-5-3-4-8-16-12/h3-9H,10H2,1-2H3
InChI Key:
PQOZUFSJXPIDRG-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1C(=O)Cc1ccccn1)C
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.11g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.29g/mol
Monoisotopic Mass:
241.11g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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