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Home > Fluorides > 1178138-96-9
1178138-96-9 | 3-(3-Fluorobenzoyl)quinoline
CAS No: 1178138-96-9 Catalog No: AG01FF8W MDL No:
Product Description
Catalog Number:
AG01FF8W
Chemical Name:
3-(3-Fluorobenzoyl)quinoline
CAS Number:
1178138-96-9
Molecular Formula:
C16H10FNO
Molecular Weight:
251.2551
IUPAC Name:
(3-fluorophenyl)-quinolin-3-ylmethanone
InChI:
InChI=1S/C16H10FNO/c17-14-6-3-5-12(9-14)16(19)13-8-11-4-1-2-7-15(11)18-10-13/h1-10H
InChI Key:
AZQHACLDMUVDTR-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)C(=O)c1cnc2c(c1)cccc2
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.075g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.26g/mol
Monoisotopic Mass:
251.075g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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