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tert-butyl 4-(1-hydroxy-2-methylpropan-2-yl)piperazine-1-carboxylate

tert-butyl 4-(1-hydroxy-2-methylpropan-2-yl)piperazine-1-carboxylate

CAS: 955979-01-8

Formula: C13H26N2O3

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

IUPAC: tert-butyl 4-(1-hydroxy-2-methylpropan-2-yl)piperazine-1-carboxylate

InChI: InChI=1S/C13H26N2O3/c1-12(2,3)18-11(17)14-6-8-15(9-7-14)13(4,5)10-16/h16H,6-10H2,1-5H3

Composition: C (60.44%), H (10.14%), N (10.84%), O (18.58%)

Molar Mass: 258.362

Atom Count: 44

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 258.194342705
Formal Charge 0
FSP3 0.92
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey KXMINCJKCWLNCF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 71.09
Topological Polar Surface Area 53.01
Polarizability 28.01
Ring Count 1
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
97% <7 Days 955979-01-8 $43.01-$2,360.88$43.01$88.83$260.87$444.13$887.32$2,360.88
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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 955979-01-8 $132.19-$593.23$132.19$132.19$235.98$235.98$593.23$593.23
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