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Home > Fluorides > 1369256-11-0
1369256-11-0 | 3-Pyridinecarbonitrile, 5-(2-fluoro-4-formylphenoxy)-
CAS No: 1369256-11-0 Catalog No: AG0012K6 MDL No:
Product Description
Catalog Number:
AG0012K6
Chemical Name:
3-Pyridinecarbonitrile, 5-(2-fluoro-4-formylphenoxy)-
CAS Number:
1369256-11-0
Molecular Formula:
C13H7FN2O2
Molecular Weight:
242.2053
IUPAC Name:
5-(2-fluoro-4-formylphenoxy)pyridine-3-carbonitrile
InChI:
InChI=1S/C13H7FN2O2/c14-12-4-9(8-17)1-2-13(12)18-11-3-10(5-15)6-16-7-11/h1-4,6-8H
InChI Key:
MKTIBTMPXRXZBN-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)F)Oc1cncc(c1)C#N
Properties
Complexity:
341
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.049g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.209g/mol
Monoisotopic Mass:
242.049g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
63A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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