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tert-butyl 4-(oxiran-2-ylmethyl)piperazine-1-carboxylate

tert-butyl 4-(oxiran-2-ylmethyl)piperazine-1-carboxylate

CAS: 159873-06-0

Formula: C12H22N2O3

SMILES: CC(C)(C)OC(=O)N1CCN(CC2CO2)CC1

IUPAC: tert-butyl 4-[(oxiran-2-yl)methyl]piperazine-1-carboxylate

InChI: InChI=1/C12H22N2O3/c1-12(2,3)17-11(15)14-6-4-13(5-7-14)8-10-9-16-10/h10H,4-9H2,1-3H3

Composition: C (59.48%), H (9.15%), N (11.56%), O (19.81%)

Molar Mass: 242.319

Atom Count: 39

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 242.163042576
Formal Charge 0
FSP3 0.92
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey XDRGUPXMFDJOFK-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 64.48
Topological Polar Surface Area 45.31
Polarizability 25.52
Ring Count 2
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 159873-06-0 $51.35-$359.43$51.35$63.37$75.38$86.31$120.18$359.43
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