1-tert-butyl 3-ethyl 5,5-difluoropiperidine-1,3-dicarboxylate

1-tert-butyl 3-ethyl 5,5-difluoropiperidine-1,3-dicarboxylate

CAS: 1356339-26-8

Formula: C13H21F2NO4

SMILES: CCOC(=O)C1CN(CC(F)(F)C1)C(=O)OC(C)(C)C

IUPAC: 1-tert-butyl 3-ethyl 5,5-difluoropiperidine-1,3-dicarboxylate

InChI: InChI=1/C13H21F2NO4/c1-5-19-10(17)9-6-13(14,15)8-16(7-9)11(18)20-12(2,3)4/h9H,5-8H2,1-4H3

Composition: C (53.23%), H (7.22%), F (12.95%), N (4.78%), O (21.82%)

Molar Mass: 293.311

Atom Count: 41

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	293.143864486
Formal Charge	0
FSP3	0.85
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	WSFZFIOMRZLJIA-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	67.61
Topological Polar Surface Area	55.84
Polarizability	26.28
Ring Count	1
Rotatable Bond Count	5

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