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10174-55-7 | Ethanone, 1-(1(2H)-quinolinyl)-
CAS No: 10174-55-7 Catalog No: AG0005DH MDL No:
Product Description
Catalog Number:
AG0005DH
Chemical Name:
Ethanone, 1-(1(2H)-quinolinyl)-
CAS Number:
10174-55-7
Molecular Formula:
C11H11NO
Molecular Weight:
173.2111
IUPAC Name:
1-(2H-quinolin-1-yl)ethanone
InChI:
InChI=1S/C11H11NO/c1-9(13)12-8-4-6-10-5-2-3-7-11(10)12/h2-7H,8H2,1H3
InChI Key:
VGEPKKUTRKZFEW-UHFFFAOYSA-N
SMILES:
CC(=O)N1CC=Cc2c1cccc2
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.084g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.215g/mol
Monoisotopic Mass:
173.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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