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

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

CAS: 2103402-31-7

Formula: C17H21ClN2O3

SMILES: CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)NC1=CC=C(Cl)C=C21

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

InChI: InChI=1S/C17H21ClN2O3/c1-16(2,3)23-15(22)20-8-6-17(7-9-20)12-10-11(18)4-5-13(12)19-14(17)21/h4-5,10H,6-9H2,1-3H3,(H,19,21)

Composition: C (60.62%), H (6.28%), Cl (10.53%), N (8.32%), O (14.25%)

Molar Mass: 336.82

Atom Count: 44

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 336.1240702
Formal Charge 0
FSP3 0.53
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey RNXZBWKYWNTRSG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 89.69
Topological Polar Surface Area 58.64
Polarizability 34.13
Ring Count 3
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 2103402-31-7 $85.75-$344.25$85.75$132.41$344.25
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