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130064-10-7 | 2-Quinolinecarboxylic acid, 6-fluoro-1,4-dihydro-4-oxo-
CAS No: 130064-10-7 Catalog No: AG000TYA MDL No:MFCD07801005
Product Description
Catalog Number:
AG000TYA
Chemical Name:
2-Quinolinecarboxylic acid, 6-fluoro-1,4-dihydro-4-oxo-
CAS Number:
130064-10-7
Molecular Formula:
C10H6FNO3
Molecular Weight:
207.1579
MDL Number:
MFCD07801005
IUPAC Name:
6-fluoro-4-oxo-1H-quinoline-2-carboxylic acid
InChI:
InChI=1S/C10H6FNO3/c11-5-1-2-7-6(3-5)9(13)4-8(12-7)10(14)15/h1-4H,(H,12,13)(H,14,15)
InChI Key:
RHDREWQIVYIOGH-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)c(=O)cc([nH]2)C(=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:
5
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:
1.4
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