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1227465-79-3 | 4-Quinolinecarboxylic acid, 7-fluoro-1,2-dihydro-2-oxo-
CAS No: 1227465-79-3 Catalog No: AG000J91 MDL No:MFCD15527354
Product Description
Catalog Number:
AG000J91
Chemical Name:
4-Quinolinecarboxylic acid, 7-fluoro-1,2-dihydro-2-oxo-
CAS Number:
1227465-79-3
Molecular Formula:
C10H6FNO3
Molecular Weight:
207.1579
MDL Number:
MFCD15527354
IUPAC Name:
7-fluoro-2-oxo-1H-quinoline-4-carboxylic acid
InChI:
InChI=1S/C10H6FNO3/c11-5-1-2-6-7(10(14)15)4-9(13)12-8(6)3-5/h1-4H,(H,12,13)(H,14,15)
InChI Key:
JNJDJHAPAYHLSZ-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)[nH]c(=O)cc2C(=O)O
Properties
Complexity:
340
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.033g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
207.16g/mol
Monoisotopic Mass:
207.033g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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