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66134-57-4 | 3-acetyl-1-ethyl-4-hydroxy-1,2-dihydroquinolin-2-one
CAS No: 66134-57-4 Catalog No: AG00IP9M MDL No:MFCD00226605
Product Description
Catalog Number:
AG00IP9M
Chemical Name:
3-acetyl-1-ethyl-4-hydroxy-1,2-dihydroquinolin-2-one
CAS Number:
66134-57-4
Molecular Formula:
C13H13NO3
Molecular Weight:
231.2472
MDL Number:
MFCD00226605
IUPAC Name:
3-acetyl-1-ethyl-4-hydroxyquinolin-2-one
InChI:
InChI=1S/C13H13NO3/c1-3-14-10-7-5-4-6-9(10)12(16)11(8(2)15)13(14)17/h4-7,16H,3H2,1-2H3
InChI Key:
MAXQRHZHOYEQQM-UHFFFAOYSA-N
SMILES:
CCn1c2ccccc2c(c(c1=O)C(=O)C)O
Properties
Complexity:
386
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.09g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
231.251g/mol
Monoisotopic Mass:
231.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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