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tert-butyl 4-[2-(pyridin-4-yl)acetyl]piperidine-1-carboxylate

tert-butyl 4-[2-(pyridin-4-yl)acetyl]piperidine-1-carboxylate

CAS: 885269-79-4

Formula: C17H24N2O3

SMILES: CC(C)(C)OC(=O)N1CCC(CC1)C(=O)CC1=CC=NC=C1

IUPAC: tert-butyl 4-[2-(pyridin-4-yl)acetyl]piperidine-1-carboxylate

InChI: InChI=1S/C17H24N2O3/c1-17(2,3)22-16(21)19-10-6-14(7-11-19)15(20)12-13-4-8-18-9-5-13/h4-5,8-9,14H,6-7,10-12H2,1-3H3

Composition: C (67.08%), H (7.95%), N (9.20%), O (15.77%)

Molar Mass: 304.39

Atom Count: 46

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 304.178692641
Formal Charge 0
FSP3 0.59
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey GJMISORDKLUHSB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 84.19
Topological Polar Surface Area 59.5
Polarizability 32.78
Ring Count 2
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 885269-79-4 $179.40-$4,597.70$179.40$243.80$373.75$631.35$1,147.70$4,597.70
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