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950648-97-2 | 5-Fluoro-2-(piperidin-4-yloxy)pyrimidinehydrochloride
CAS No: 950648-97-2 Catalog No: AG01EZL6 MDL No:
Product Description
Catalog Number:
AG01EZL6
Chemical Name:
5-Fluoro-2-(piperidin-4-yloxy)pyrimidinehydrochloride
CAS Number:
950648-97-2
Molecular Formula:
C9H13ClFN3O
Molecular Weight:
233.6704
IUPAC Name:
5-fluoro-2-piperidin-4-yloxypyrimidine;hydrochloride
InChI:
InChI=1S/C9H12FN3O.ClH/c10-7-5-12-9(13-6-7)14-8-1-3-11-4-2-8;/h5-6,8,11H,1-4H2;1H
InChI Key:
DGJDKWJEDXAVSV-UHFFFAOYSA-N
SMILES:
Fc1cnc(nc1)OC1CCNCC1.Cl
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.073g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
233.671g/mol
Monoisotopic Mass:
233.073g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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