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Home > Fluorides > 145835-09-2
145835-09-2 | 3-Pyridinecarbonitrile, 6-[2-(4-fluorophenyl)-2-oxoethyl]-
CAS No: 145835-09-2 Catalog No: AG001DGM MDL No:
Product Description
Catalog Number:
AG001DGM
Chemical Name:
3-Pyridinecarbonitrile, 6-[2-(4-fluorophenyl)-2-oxoethyl]-
CAS Number:
145835-09-2
Molecular Formula:
C14H9FN2O
Molecular Weight:
240.2325
IUPAC Name:
6-[2-(4-fluorophenyl)-2-oxoethyl]pyridine-3-carbonitrile
InChI:
InChI=1S/C14H9FN2O/c15-12-4-2-11(3-5-12)14(18)7-13-6-1-10(8-16)9-17-13/h1-6,9H,7H2
InChI Key:
ASBTXFRDJATCKA-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(nc1)CC(=O)c1ccc(cc1)F
Properties
Complexity:
341
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.07g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.237g/mol
Monoisotopic Mass:
240.07g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
53.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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