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ethyl 2-{2-[(tert-butoxycarbonyl)amino]pyridin-4-yl}acetate

ethyl 2-{2-[(tert-butoxycarbonyl)amino]pyridin-4-yl}acetate

CAS: 474679-02-2

Formula: C14H20N2O4

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

IUPAC: ethyl 2-(2-{[(tert-butoxy)carbonyl]amino}pyridin-4-yl)acetate

InChI: InChI=1S/C14H20N2O4/c1-5-19-12(17)9-10-6-7-15-11(8-10)16-13(18)20-14(2,3)4/h6-8H,5,9H2,1-4H3,(H,15,16,18)

Composition: C (59.99%), H (7.19%), N (9.99%), O (22.83%)

Molar Mass: 280.324

Atom Count: 40

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 280.142307132
Formal Charge 0
FSP3 0.5
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey TXDOPQKWPQENRR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 75.33
Topological Polar Surface Area 77.52
Polarizability 28.7
Ring Count 1
Rotatable Bond Count 7

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96% <2 Days 474679-02-2 $631.35-$4,597.70$631.35$1,147.70$4,597.70
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