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Home Other Building Blocks ACETIC ACID 2-OXO-1,2-DIHYDRO-QUINOLIN-8-YL ESTER

ACETIC ACID 2-OXO-1,2-DIHYDRO-QUINOLIN-8-YL ESTER

CAS No.:
15450-72-3
Catalog Number:
AG00ATOT
Molecular Formula:
C11H9NO3
Molecular Weight:
203.1941
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Product Description
Catalog Number:
AG00ATOT
Chemical Name:
ACETIC ACID 2-OXO-1,2-DIHYDRO-QUINOLIN-8-YL ESTER
CAS Number:
15450-72-3
Molecular Formula:
C11H9NO3
Molecular Weight:
203.1941
MDL Number:
MFCD00169013
IUPAC Name:
(2-oxo-1H-quinolin-8-yl) acetate
InChI:
InChI=1S/C11H9NO3/c1-7(13)15-9-4-2-3-8-5-6-10(14)12-11(8)9/h2-6H,1H3,(H,12,14)
InChI Key:
UTMRKCQYCLEKDL-UHFFFAOYSA-N
SMILES:
CC(=O)Oc1cccc2c1[nH]c(=O)cc2
EC Number:
604-961-2
NSC Number:
108382
Properties
Complexity:
311  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.058g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
203.197g/mol
Monoisotopic Mass:
203.058g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties