tert-butyl 4,4-difluoro-3-(prop-2-en-1-yl)piperidine-1-carboxylate

tert-butyl 4,4-difluoro-3-(prop-2-en-1-yl)piperidine-1-carboxylate

CAS: 2101206-71-5

Formula: C13H21F2NO2

SMILES: CC(C)(C)OC(=O)N1CCC(F)(F)C(CC=C)C1

IUPAC: tert-butyl 4,4-difluoro-3-(prop-2-en-1-yl)piperidine-1-carboxylate

InChI: InChI=1/C13H21F2NO2/c1-5-6-10-9-16(8-7-13(10,14)15)11(17)18-12(2,3)4/h5,10H,1,6-9H2,2-4H3

Composition: C (59.75%), H (8.10%), F (14.54%), N (5.36%), O (12.25%)

Molar Mass: 261.313

Atom Count: 39

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	261.154035246
Formal Charge	0
FSP3	0.77
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	NUQGCJDIKHZYMX-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	65.16
Topological Polar Surface Area	29.54
Polarizability	25.1
Ring Count	1
Rotatable Bond Count	4

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