ethyl 4-(trifluoromethyl)piperidine-2-carboxylate

ethyl 4-(trifluoromethyl)piperidine-2-carboxylate

CAS: 2167514-96-5

Formula: C9H14F3NO2

SMILES: CCOC(=O)C1CC(CCN1)C(F)(F)F

IUPAC: ethyl 4-(trifluoromethyl)piperidine-2-carboxylate

InChI: InChI=1/C9H14F3NO2/c1-2-15-8(14)7-5-6(3-4-13-7)9(10,11)12/h6-7,13H,2-5H2,1H3

Composition: C (48.00%), H (6.27%), F (25.31%), N (6.22%), O (14.21%)

Molar Mass: 225.211

Atom Count: 29

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	2
Exact Mass	225.097663184
Formal Charge	0
FSP3	0.89
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	LYYMARWKSIBKPA-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.59
Topological Polar Surface Area	38.33
Polarizability	18.35
Ring Count	1
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
96%	<2 Days	2167514-96-5		$221.95-$6,762.00$221.95$327.75$540.50$966.00$1,817.00$6,762.00