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89246-59-3 | 2(1H)-Pyridinone, 1-ethyl-6-hydroxy-5-(1-iminoethyl)-4-methyl-
CAS No: 89246-59-3 Catalog No: AG0042IN MDL No:
Product Description
Catalog Number:
AG0042IN
Chemical Name:
2(1H)-Pyridinone, 1-ethyl-6-hydroxy-5-(1-iminoethyl)-4-methyl-
CAS Number:
89246-59-3
Molecular Formula:
C10H14N2O2
Molecular Weight:
194.2304
IUPAC Name:
5-ethanimidoyl-1-ethyl-6-hydroxy-4-methylpyridin-2-one
InChI:
InChI=1S/C10H14N2O2/c1-4-12-8(13)5-6(2)9(7(3)11)10(12)14/h5,11,14H,4H2,1-3H3
InChI Key:
HAWMQKPSPNFMQQ-UHFFFAOYSA-N
SMILES:
CCn1c(=O)cc(c(c1O)C(=N)C)C
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.106g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
194.234g/mol
Monoisotopic Mass:
194.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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