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69003-17-4 | 1-Methyl-5,6-dihydropyridin-2(1H)-one
CAS No: 69003-17-4 Catalog No: AG01EDA7 MDL No:
Product Description
Catalog Number:
AG01EDA7
Chemical Name:
1-Methyl-5,6-dihydropyridin-2(1H)-one
CAS Number:
69003-17-4
IUPAC Name:
1-methyl-2,3-dihydropyridin-6-one
InChI:
InChI=1S/C6H9NO/c1-7-5-3-2-4-6(7)8/h2,4H,3,5H2,1H3
InChI Key:
HZNHVKIJLRXCOQ-UHFFFAOYSA-N
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
111.068g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
111.144g/mol
Monoisotopic Mass:
111.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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