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1242260-40-7 | 3-Quinolinecarboxylic acid, 4-amino-7-fluoro-
CAS No: 1242260-40-7 Catalog No: AG000LPR MDL No:
Product Description
Catalog Number:
AG000LPR
Chemical Name:
3-Quinolinecarboxylic acid, 4-amino-7-fluoro-
CAS Number:
1242260-40-7
Molecular Formula:
C10H7FN2O2
Molecular Weight:
206.1732
IUPAC Name:
4-amino-7-fluoroquinoline-3-carboxylic acid
InChI:
InChI=1S/C10H7FN2O2/c11-5-1-2-6-8(3-5)13-4-7(9(6)12)10(14)15/h1-4H,(H2,12,13)(H,14,15)
InChI Key:
NWWNOKZSLAWADK-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)ncc(c2N)C(=O)O
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.049g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
206.176g/mol
Monoisotopic Mass:
206.049g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
76.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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