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82878-59-9 | 4-(Fluoromethyl)pyridine
CAS No: 82878-59-9 Catalog No: AG004SC6 MDL No:
Product Description
Catalog Number:
AG004SC6
Chemical Name:
4-(Fluoromethyl)pyridine
CAS Number:
82878-59-9
Molecular Formula:
C6H6FN
Molecular Weight:
111.1169
IUPAC Name:
4-(fluoromethyl)pyridine
InChI:
InChI=1S/C6H6FN/c7-5-6-1-3-8-4-2-6/h1-4H,5H2
InChI Key:
PXJHVEMRKKQTNS-UHFFFAOYSA-N
SMILES:
FCc1ccncc1
Properties
Complexity:
59.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
111.048g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
111.119g/mol
Monoisotopic Mass:
111.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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