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13884-26-9 | 4-Quinolinecarboxamide, 2-ethoxy-
CAS No: 13884-26-9 Catalog No: AG007LIO MDL No:
Product Description
Catalog Number:
AG007LIO
Chemical Name:
4-Quinolinecarboxamide, 2-ethoxy-
CAS Number:
13884-26-9
Molecular Formula:
C12H12N2O2
Molecular Weight:
216.2359
IUPAC Name:
2-ethoxyquinoline-4-carboxamide
InChI:
InChI=1S/C12H12N2O2/c1-2-16-11-7-9(12(13)15)8-5-3-4-6-10(8)14-11/h3-7H,2H2,1H3,(H2,13,15)
InChI Key:
HIQNSVJSPWJJAM-UHFFFAOYSA-N
SMILES:
CCOc1nc2ccccc2c(c1)C(=O)N
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
216.24g/mol
Monoisotopic Mass:
216.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
65.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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