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4-[3-(3-chloro-4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidine

4-[3-(3-chloro-4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidine

Formula: C13H13ClFN3O

SMILES: FC1=C(Cl)C=C(C=C1)C1=NOC(=N1)C1CCNCC1

IUPAC: 4-[3-(3-chloro-4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidine

InChI: InChI=1S/C13H13ClFN3O/c14-10-7-9(1-2-11(10)15)12-17-13(19-18-12)8-3-5-16-6-4-8/h1-2,7-8,16H,3-6H2

Composition: C (55.43%), H (4.65%), Cl (12.58%), F (6.74%), N (14.92%), O (5.68%)

Molar Mass: 281.72

Atom Count: 32

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 281.0731179
Formal Charge 0
FSP3 0.38
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey FFSDJUCSJPGMEX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 81.98
Topological Polar Surface Area 50.95
Polarizability 27.25
Ring Count 3
Rotatable Bond Count 2

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Struchem co.,ltd
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Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C13H13ClFN3O $1,300.00-$2,574.00$1,300.00$1,760.00$2,574.00
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