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126866-15-7 | Ethanone, 1-(4-chlorophenyl)-2-(4-fluorophenyl)-
CAS No: 126866-15-7 Catalog No: AG000TE1 MDL No:
Product Description
Catalog Number:
AG000TE1
Chemical Name:
Ethanone, 1-(4-chlorophenyl)-2-(4-fluorophenyl)-
CAS Number:
126866-15-7
Molecular Formula:
C14H10ClFO
Molecular Weight:
248.6800
IUPAC Name:
1-(4-chlorophenyl)-2-(4-fluorophenyl)ethanone
InChI:
InChI=1S/C14H10ClFO/c15-12-5-3-11(4-6-12)14(17)9-10-1-7-13(16)8-2-10/h1-8H,9H2
InChI Key:
DEWHNPKDNJHLIN-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)CC(=O)c1ccc(cc1)Cl
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.04g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.681g/mol
Monoisotopic Mass:
248.04g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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