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1-tert-butyl 4-methyl piperidine-1,4-dicarboxylate

1-tert-butyl 4-methyl piperidine-1,4-dicarboxylate

CAS: 124443-68-1

Formula: C12H21NO4

SMILES: COC(=O)C1CCN(CC1)C(=O)OC(C)(C)C

IUPAC: 1-tert-butyl 4-methyl piperidine-1,4-dicarboxylate

InChI: InChI=1S/C12H21NO4/c1-12(2,3)17-11(15)13-7-5-9(6-8-13)10(14)16-4/h9H,5-8H2,1-4H3

Composition: C (59.24%), H (8.70%), N (5.76%), O (26.30%)

Molar Mass: 243.303

Atom Count: 38

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 243.14705816
Formal Charge 0
FSP3 0.83
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey PTZNCCIULVXFIJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.84
Topological Polar Surface Area 55.84
Polarizability 24.82
Ring Count 1
Rotatable Bond Count 4

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