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1253972-47-2 | Ethanone, 1-(2-chloro-6-quinolinyl)-
CAS No: 1253972-47-2 Catalog No: AG000NLZ MDL No:
Product Description
Catalog Number:
AG000NLZ
Chemical Name:
Ethanone, 1-(2-chloro-6-quinolinyl)-
CAS Number:
1253972-47-2
Molecular Formula:
C11H8ClNO
Molecular Weight:
205.6403
IUPAC Name:
1-(2-chloroquinolin-6-yl)ethanone
InChI:
InChI=1S/C11H8ClNO/c1-7(14)8-2-4-10-9(6-8)3-5-11(12)13-10/h2-6H,1H3
InChI Key:
ZPCMVVIPEADIAN-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(n1)ccc(c2)C(=O)C
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.029g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.641g/mol
Monoisotopic Mass:
205.029g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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