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1416439-59-2 | 3-Quinolinecarboxylic acid, 5-amino-
CAS No: 1416439-59-2 Catalog No: AG001GS7 MDL No:MFCD22690567
Product Description
Catalog Number:
AG001GS7
Chemical Name:
3-Quinolinecarboxylic acid, 5-amino-
CAS Number:
1416439-59-2
Molecular Formula:
C10H8N2O2
Molecular Weight:
188.1827
MDL Number:
MFCD22690567
IUPAC Name:
5-aminoquinoline-3-carboxylic acid
InChI:
InChI=1S/C10H8N2O2/c11-8-2-1-3-9-7(8)4-6(5-12-9)10(13)14/h1-5H,11H2,(H,13,14)
InChI Key:
KQHMZYFYTXCZQM-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc2c(c1)c(N)ccc2
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.059g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
188.186g/mol
Monoisotopic Mass:
188.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
76.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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