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Home > Fluorides > 1283109-72-7
1283109-72-7 | 3-Acetyl-4-(3,4-difluorophenyl)-6-fluoroquinolin-2(1H)-one
CAS No: 1283109-72-7 Catalog No: AG01APNJ MDL No:MFCD21091976
Product Description
Catalog Number:
AG01APNJ
Chemical Name:
3-Acetyl-4-(3,4-difluorophenyl)-6-fluoroquinolin-2(1H)-one
CAS Number:
1283109-72-7
Molecular Formula:
C17H10F3NO2
Molecular Weight:
317.2620
MDL Number:
MFCD21091976
IUPAC Name:
3-acetyl-4-(3,4-difluorophenyl)-6-fluoro-1H-quinolin-2-one
InChI:
InChI=1S/C17H10F3NO2/c1-8(22)15-16(9-2-4-12(19)13(20)6-9)11-7-10(18)3-5-14(11)21-17(15)23/h2-7H,1H3,(H,21,23)
InChI Key:
XJLOXDSPXWORBG-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)c(c1ccc(c(c1)F)F)c(c(=O)[nH]2)C(=O)C
Properties
Complexity:
548
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.066g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
317.267g/mol
Monoisotopic Mass:
317.066g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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