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ethyl 1-benzyl-3-[(tert-butoxycarbonyl)amino]piperidine-4-carboxylate

ethyl 1-benzyl-3-[(tert-butoxycarbonyl)amino]piperidine-4-carboxylate

CAS: 2407051-38-9

Formula: C20H30N2O4

SMILES: CCOC(=O)C1CCN(CC2=CC=CC=C2)CC1NC(=O)OC(C)(C)C

IUPAC: ethyl 1-benzyl-3-{[(tert-butoxy)carbonyl]amino}piperidine-4-carboxylate

InChI: InChI=1/C20H30N2O4/c1-5-25-18(23)16-11-12-22(13-15-9-7-6-8-10-15)14-17(16)21-19(24)26-20(2,3)4/h6-10,16-17H,5,11-14H2,1-4H3,(H,21,24)

Composition: C (66.27%), H (8.34%), N (7.73%), O (17.66%)

Molar Mass: 362.47

Atom Count: 56

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 2
Exact Mass 362.220557454
Formal Charge 0
FSP3 0.6
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey XAWZMEMDSCFQDQ-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 100.24
Topological Polar Surface Area 67.87
Polarizability 39.58
Ring Count 2
Rotatable Bond Count 8

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96% <2 Days 2407051-38-9 $221.95-$6,762.00$221.95$327.75$540.50$966.00$1,817.00$6,762.00
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