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1414959-01-5 | 5-Quinolinecarboxylic acid, 2-amino-, methyl ester
CAS No: 1414959-01-5 Catalog No: AG001GHW MDL No:
Product Description
Catalog Number:
AG001GHW
Chemical Name:
5-Quinolinecarboxylic acid, 2-amino-, methyl ester
CAS Number:
1414959-01-5
Molecular Formula:
C11H10N2O2
Molecular Weight:
202.2093
IUPAC Name:
methyl 2-aminoquinoline-5-carboxylate
InChI:
InChI=1S/C11H10N2O2/c1-15-11(14)8-3-2-4-9-7(8)5-6-10(12)13-9/h2-6H,1H3,(H2,12,13)
InChI Key:
NYLRJBGBKPAPSZ-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc2c1ccc(n2)N
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.074g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.213g/mol
Monoisotopic Mass:
202.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
65.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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