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Home > Quinoline > 921211-28-1
921211-28-1 | 6-Quinolinecarboxamide, 2-chloro-N-(1-methylethyl)-
CAS No: 921211-28-1 Catalog No: AG00664V MDL No:
Product Description
Catalog Number:
AG00664V
Chemical Name:
6-Quinolinecarboxamide, 2-chloro-N-(1-methylethyl)-
CAS Number:
921211-28-1
Molecular Formula:
C13H13ClN2O
Molecular Weight:
248.7081
IUPAC Name:
2-chloro-N-propan-2-ylquinoline-6-carboxamide
InChI:
InChI=1S/C13H13ClN2O/c1-8(2)15-13(17)10-3-5-11-9(7-10)4-6-12(14)16-11/h3-8H,1-2H3,(H,15,17)
InChI Key:
HTTIUWJIRRSHEE-UHFFFAOYSA-N
SMILES:
CC(NC(=O)c1ccc2c(c1)ccc(n2)Cl)C
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.072g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.71g/mol
Monoisotopic Mass:
248.072g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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