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1257535-67-3 | 3-Acetyl-6-chloro-4-(4-fluorophenyl)quinolin-2(1H)-one
CAS No: 1257535-67-3 Catalog No: AG01APO1 MDL No:MFCD21091738
Product Description
Catalog Number:
AG01APO1
Chemical Name:
3-Acetyl-6-chloro-4-(4-fluorophenyl)quinolin-2(1H)-one
CAS Number:
1257535-67-3
Molecular Formula:
C17H11ClFNO2
Molecular Weight:
315.7261
MDL Number:
MFCD21091738
IUPAC Name:
3-acetyl-6-chloro-4-(4-fluorophenyl)-1H-quinolin-2-one
InChI:
InChI=1S/C17H11ClFNO2/c1-9(21)15-16(10-2-5-12(19)6-3-10)13-8-11(18)4-7-14(13)20-17(15)22/h2-8H,1H3,(H,20,22)
InChI Key:
VHUIIUFZIMAPMX-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)c1c(C(=O)C)c(=O)[nH]c2c1cc(Cl)cc2
Properties
Complexity:
511
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.046g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
315.728g/mol
Monoisotopic Mass:
315.046g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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