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Home > Pyridines > 114578-66-4
114578-66-4 | Ethanone, 1,1'-(4-methyl-2,6-pyridinediyl)bis-
CAS No: 114578-66-4 Catalog No: AG000EQ7 MDL No:
Product Description
Catalog Number:
AG000EQ7
Chemical Name:
Ethanone, 1,1'-(4-methyl-2,6-pyridinediyl)bis-
CAS Number:
114578-66-4
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
IUPAC Name:
1-(6-acetyl-4-methylpyridin-2-yl)ethanone
InChI:
InChI=1S/C10H11NO2/c1-6-4-9(7(2)12)11-10(5-6)8(3)13/h4-5H,1-3H3
InChI Key:
MILWOFXNHDEODM-UHFFFAOYSA-N
SMILES:
Cc1cc(nc(c1)C(=O)C)C(=O)C
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.079g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.203g/mol
Monoisotopic Mass:
177.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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