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125579-10-4 | Ethanone, 2-chloro-1-(6-fluoro-3,4-dihydro-1(2H)-quinolinyl)-
CAS No: 125579-10-4 Catalog No: AG000NWM MDL No:
Product Description
Catalog Number:
AG000NWM
Chemical Name:
Ethanone, 2-chloro-1-(6-fluoro-3,4-dihydro-1(2H)-quinolinyl)-
CAS Number:
125579-10-4
Molecular Formula:
C11H11ClFNO
Molecular Weight:
227.6625
IUPAC Name:
2-chloro-1-(6-fluoro-3,4-dihydro-2H-quinolin-1-yl)ethanone
InChI:
InChI=1S/C11H11ClFNO/c12-7-11(15)14-5-1-2-8-6-9(13)3-4-10(8)14/h3-4,6H,1-2,5,7H2
InChI Key:
VTAOQYAHIDMKET-UHFFFAOYSA-N
SMILES:
ClCC(=O)N1CCCc2c1ccc(c2)F
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.051g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.663g/mol
Monoisotopic Mass:
227.051g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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