tert-butyl 4-[(1S)-2,2,2-trifluoro-1-hydroxyethyl]piperidine-1-carboxylate

tert-butyl 4-[(1S)-2,2,2-trifluoro-1-hydroxyethyl]piperidine-1-carboxylate

CAS: 2227693-01-6

Formula: C12H20F3NO3

SMILES: CC(C)(C)OC(=O)N1CCC(CC1)[C@H](O)C(F)(F)F

IUPAC: tert-butyl 4-[(1S)-2,2,2-trifluoro-1-hydroxyethyl]piperidine-1-carboxylate

InChI: InChI=1S/C12H20F3NO3/c1-11(2,3)19-10(18)16-6-4-8(5-7-16)9(17)12(13,14)15/h8-9,17H,4-7H2,1-3H3/t9-/m0/s1

Composition: C (50.88%), H (7.12%), F (20.12%), N (4.94%), O (16.94%)

Molar Mass: 283.291

Atom Count: 39

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	283.139527997
Formal Charge	0
FSP3	0.92
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	HARLHGMSRKJSSA-VIFPVBQESA-N
Lipinski's Rule of Five	1
Molar Refractivity	63.35
Topological Polar Surface Area	49.77
Polarizability	24.11
Ring Count	1
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	2227693-01-6		$346.78-$554.84$346.78$554.84