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1-benzyl 2-tert-butyl piperidine-1,2-dicarboxylate

1-benzyl 2-tert-butyl piperidine-1,2-dicarboxylate

CAS: 71170-89-3

Formula: C18H25NO4

SMILES: CC(C)(C)OC(=O)C1CCCCN1C(=O)OCC1=CC=CC=C1

IUPAC: 1-benzyl 2-tert-butyl piperidine-1,2-dicarboxylate

InChI: InChI=1/C18H25NO4/c1-18(2,3)23-16(20)15-11-7-8-12-19(15)17(21)22-13-14-9-5-4-6-10-14/h4-6,9-10,15H,7-8,11-13H2,1-3H3

Composition: C (67.69%), H (7.89%), N (4.39%), O (20.04%)

Molar Mass: 319.401

Atom Count: 48

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 319.178358289
Formal Charge 0
FSP3 0.56
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey SQJWZSZKXPYXAM-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 87.04
Topological Polar Surface Area 55.84
Polarizability 34.37
Ring Count 2
Rotatable Bond Count 6

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