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93574-03-9 | 2(1H)-Quinolinone, 4-hydroxy-3-(2-hydroxyethyl)-1-methyl-
CAS No: 93574-03-9 Catalog No: AG0061ZW MDL No:
Product Description
Catalog Number:
AG0061ZW
Chemical Name:
2(1H)-Quinolinone, 4-hydroxy-3-(2-hydroxyethyl)-1-methyl-
CAS Number:
93574-03-9
Molecular Formula:
C12H13NO3
Molecular Weight:
219.2365
IUPAC Name:
4-hydroxy-3-(2-hydroxyethyl)-1-methylquinolin-2-one
InChI:
InChI=1S/C12H13NO3/c1-13-10-5-3-2-4-8(10)11(15)9(6-7-14)12(13)16/h2-5,14-15H,6-7H2,1H3
InChI Key:
ZHGUWWUYJBJTJC-UHFFFAOYSA-N
SMILES:
OCCc1c(O)c2ccccc2n(c1=O)C
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
219.24g/mol
Monoisotopic Mass:
219.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
60.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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