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{[4-(tert-butoxycarbonyl)piperazin-1-yl]methyl}trifluoroboranuide

{[4-(tert-butoxycarbonyl)piperazin-1-yl]methyl}trifluoroboranuide

CAS: 1268340-97-1

Formula: C10H19BF3N2O2

SMILES: CC(C)(C)OC(=O)N1CCN(C[B-](F)(F)F)CC1

IUPAC: ({4-[(tert-butoxy)carbonyl]piperazin-1-yl}methyl)trifluoroboranuide

InChI: InChI=1S/C10H19BF3N2O2/c1-10(2,3)18-9(17)16-6-4-15(5-7-16)8-11(12,13)14/h4-8H2,1-3H3/q-1

Composition: C (44.97%), H (7.17%), B (4.05%), F (21.34%), N (10.49%), O (11.98%)

Molar Mass: 267.08

Atom Count: 37

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 267.149716
Formal Charge -1
FSP3 0.9
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey ZMODHXXZBLTZED-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.97
Topological Polar Surface Area 32.78
Polarizability 23.51
Ring Count 1
Rotatable Bond Count 4

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