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tert-butyl 6-fluoro-3-hydroxy-2,3-dihydrospiro[indene-1,4'-piperidine]-1'-carboxylate

tert-butyl 6-fluoro-3-hydroxy-2,3-dihydrospiro[indene-1,4'-piperidine]-1'-carboxylate

CAS: 1965310-09-1

Formula: C18H24FNO3

SMILES: CC(C)(C)OC(=O)N1CCC2(CC(O)C3=CC=C(F)C=C23)CC1

IUPAC: tert-butyl 6-fluoro-3-hydroxy-2,3-dihydrospiro[indene-1,4'-piperidine]-1'-carboxylate

InChI: InChI=1/C18H24FNO3/c1-17(2,3)23-16(22)20-8-6-18(7-9-20)11-15(21)13-5-4-12(19)10-14(13)18/h4-5,10,15,21H,6-9,11H2,1-3H3

Composition: C (67.27%), H (7.53%), F (5.91%), N (4.36%), O (14.93%)

Molar Mass: 321.392

Atom Count: 47

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 321.1740218
Formal Charge 0
FSP3 0.61
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey NIWRKVCIELMQRN-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 85.92
Topological Polar Surface Area 49.77
Polarizability 33.17
Ring Count 3
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 1965310-09-1 $221.95-$6,762.00$221.95$327.75$540.50$966.00$1,817.00$6,762.00
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