tert-butyl N-[(3R,5S)-5-(difluoromethyl)piperidin-3-yl]carbamate

tert-butyl N-[(3R,5S)-5-(difluoromethyl)piperidin-3-yl]carbamate

CAS: 2306254-30-6

Formula: C11H20F2N2O2

SMILES: CC(C)(C)OC(=O)N[C@H]1CNC[C@H](C1)C(F)F

IUPAC: tert-butyl N-[(3R,5S)-5-(difluoromethyl)piperidin-3-yl]carbamate

InChI: InChI=1S/C11H20F2N2O2/c1-11(2,3)17-10(16)15-8-4-7(9(12)13)5-14-6-8/h7-9,14H,4-6H2,1-3H3,(H,15,16)/t7-,8+/m0/s1

Composition: C (52.79%), H (8.05%), F (15.18%), N (11.19%), O (12.78%)

Molar Mass: 250.29

Atom Count: 37

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	2
Exact Mass	250.149284218
Formal Charge	0
FSP3	0.91
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	ATHHDYBFMRSHLU-JGVFFNPUSA-N
Lipinski's Rule of Five	1
Molar Refractivity	59.09
Topological Polar Surface Area	50.36
Polarizability	23.25
Ring Count	1
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	2306254-30-6		$372.00-$4,598.87$372.00$614.11$1,022.67$1,533.38$4,598.87