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79075-12-0 | 2(1H)-Quinolinone, 3-acetyl-4-hydroxy-6-methyl-
CAS No: 79075-12-0 Catalog No: AG008N1X MDL No:MFCD24555893
Product Description
Catalog Number:
AG008N1X
Chemical Name:
2(1H)-Quinolinone, 3-acetyl-4-hydroxy-6-methyl-
CAS Number:
79075-12-0
Molecular Formula:
C12H11NO3
Molecular Weight:
217.2206
MDL Number:
MFCD24555893
IUPAC Name:
3-acetyl-4-hydroxy-6-methyl-1H-quinolin-2-one
InChI:
InChI=1S/C12H11NO3/c1-6-3-4-9-8(5-6)11(15)10(7(2)14)12(16)13-9/h3-5H,1-2H3,(H2,13,15,16)
InChI Key:
XRUOUJOYAGEBTK-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)c(O)c(c(=O)[nH]2)C(=O)C
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.074g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
217.224g/mol
Monoisotopic Mass:
217.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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