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tert-butyl 5-fluoro-2H-spiro[indole-3,4'-piperidine]-1-carboxylate

tert-butyl 5-fluoro-2H-spiro[indole-3,4'-piperidine]-1-carboxylate

CAS: 858351-47-0

Formula: C17H23FN2O2

SMILES: CC(C)(C)OC(=O)N1CC2(CCNCC2)C2=CC(F)=CC=C12

IUPAC: tert-butyl 5-fluoro-1,2-dihydrospiro[indole-3,4'-piperidine]-1-carboxylate

InChI: InChI=1S/C17H23FN2O2/c1-16(2,3)22-15(21)20-11-17(6-8-19-9-7-17)13-10-12(18)4-5-14(13)20/h4-5,10,19H,6-9,11H2,1-3H3

Composition: C (66.64%), H (7.57%), F (6.20%), N (9.14%), O (10.44%)

Molar Mass: 306.381

Atom Count: 45

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 306.174356152
Formal Charge 0
FSP3 0.59
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey GPKKXSAFDWGFOL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 83.09
Topological Polar Surface Area 41.57
Polarizability 32.21
Ring Count 3
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 858351-47-0 $189.15-$1,948.25$189.15$302.64$441.35$649.42$1,948.25
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