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tert-butyl (2S,5R)-2,5-dimethylpiperazine-1-carboxylate

tert-butyl (2S,5R)-2,5-dimethylpiperazine-1-carboxylate

CAS: 548762-66-9

Formula: C11H22N2O2

SMILES: C[C@@H]1CN([C@@H](C)CN1)C(=O)OC(C)(C)C

IUPAC: tert-butyl (2S,5R)-2,5-dimethylpiperazine-1-carboxylate

InChI: InChI=1S/C11H22N2O2/c1-8-7-13(9(2)6-12-8)10(14)15-11(3,4)5/h8-9,12H,6-7H2,1-5H3/t8-,9+/m1/s1

Composition: C (61.65%), H (10.35%), N (13.07%), O (14.93%)

Molar Mass: 214.309

Atom Count: 37

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 214.168127956
Formal Charge 0
FSP3 0.91
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey PGZCVLUQTJRRAA-BDAKNGLRSA-N
Lipinski's Rule of Five 1
Molar Refractivity 59.28
Topological Polar Surface Area 41.57
Polarizability 23.69
Ring Count 1
Rotatable Bond Count 2

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