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23586-89-2 | 3-Pyridinecarboxylic acid, 5-fluoro-, 1,6-hexanediyl ester (9CI)
CAS No: 23586-89-2 Catalog No: AG002NSI MDL No:
Product Description
Catalog Number:
AG002NSI
Chemical Name:
3-Pyridinecarboxylic acid, 5-fluoro-, 1,6-hexanediyl ester (9CI)
CAS Number:
23586-89-2
IUPAC Name:
6-(5-fluoropyridine-3-carbonyl)oxyhexyl 5-fluoropyridine-3-carboxylate
InChI:
InChI=1S/C18H18F2N2O4/c19-15-7-13(9-21-11-15)17(23)25-5-3-1-2-4-6-26-18(24)14-8-16(20)12-22-10-14/h7-12H,1-6H2
InChI Key:
JYLMYTKLNCGRFX-UHFFFAOYSA-N
Properties
Complexity:
413
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
364.123g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
364.349g/mol
Monoisotopic Mass:
364.123g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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