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3-[(tert-butoxycarbonyl)amino]-4-(pyridin-3-yl)butanoic acid

3-[(tert-butoxycarbonyl)amino]-4-(pyridin-3-yl)butanoic acid

Formula: C14H20N2O4

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

IUPAC: 3-{[(tert-butoxy)carbonyl]amino}-4-(pyridin-3-yl)butanoic acid

InChI: InChI=1/C14H20N2O4/c1-14(2,3)20-13(19)16-11(8-12(17)18)7-10-5-4-6-15-9-10/h4-6,9,11H,7-8H2,1-3H3,(H,16,19)(H,17,18)

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 1
Exact Mass 280.142307132
Formal Charge 0
FSP3 0.5
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey JSWWEGRTQTXLFX-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 72.46
Topological Polar Surface Area 88.52
Polarizability 28.46
Ring Count 1
Rotatable Bond Count 7

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Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C14H20N2O4 Quote Only
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