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63010-69-5 | Ethyl 8-Fluoro-4-hydroxyquinoline-3-carboxylate
CAS No: 63010-69-5 Catalog No: AG003QE2 MDL No:MFCD00173363
Product Description
Catalog Number:
AG003QE2
Chemical Name:
Ethyl 8-Fluoro-4-hydroxyquinoline-3-carboxylate
CAS Number:
63010-69-5
Molecular Formula:
C12H10FNO3
Molecular Weight:
235.2111
MDL Number:
MFCD00173363
IUPAC Name:
ethyl 8-fluoro-4-oxo-1H-quinoline-3-carboxylate
InChI:
InChI=1S/C12H10FNO3/c1-2-17-12(16)8-6-14-10-7(11(8)15)4-3-5-9(10)13/h3-6H,2H2,1H3,(H,14,15)
InChI Key:
MPUYCZQHTGRPNE-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cnc2c(c1O)cccc2F
Properties
Complexity:
367
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.064g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
235.214g/mol
Monoisotopic Mass:
235.064g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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