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1-tert-butyl 3-methyl 4-methylpiperidine-1,3-dicarboxylate

1-tert-butyl 3-methyl 4-methylpiperidine-1,3-dicarboxylate

CAS: 1201192-62-2

Formula: C13H23NO4

SMILES: COC(=O)C1CN(CCC1C)C(=O)OC(C)(C)C

IUPAC: 1-tert-butyl 3-methyl 4-methylpiperidine-1,3-dicarboxylate

InChI: InChI=1/C13H23NO4/c1-9-6-7-14(8-10(9)11(15)17-5)12(16)18-13(2,3)4/h9-10H,6-8H2,1-5H3

Composition: C (60.68%), H (9.01%), N (5.44%), O (24.87%)

Molar Mass: 257.33

Atom Count: 41

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 257.162708225
Formal Charge 0
FSP3 0.85
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey CUBAIJGHSDICOZ-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 67.23
Topological Polar Surface Area 55.84
Polarizability 26.66
Ring Count 1
Rotatable Bond Count 4

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