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Home > Fluorides > 115858-98-5
115858-98-5 | Ethanone, 2-(4-fluorophenyl)-1-(4-pyridinyl)-
CAS No: 115858-98-5 Catalog No: AG000GYO MDL No:MFCD04114369
Product Description
Catalog Number:
AG000GYO
Chemical Name:
Ethanone, 2-(4-fluorophenyl)-1-(4-pyridinyl)-
CAS Number:
115858-98-5
Molecular Formula:
C13H10FNO
Molecular Weight:
215.2230
MDL Number:
MFCD04114369
IUPAC Name:
2-(4-fluorophenyl)-1-pyridin-4-ylethanone
InChI:
InChI=1S/C13H10FNO/c14-12-3-1-10(2-4-12)9-13(16)11-5-7-15-8-6-11/h1-8H,9H2
InChI Key:
SWLMSOXBPVFLNF-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)CC(=O)c1ccncc1
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.075g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.227g/mol
Monoisotopic Mass:
215.075g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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