tert-butyl N-[(3S)-4,4-difluoropiperidin-3-yl]carbamate

tert-butyl N-[(3S)-4,4-difluoropiperidin-3-yl]carbamate

CAS: 2089321-16-2

Formula: C10H18F2N2O2

SMILES: CC(C)(C)OC(=O)N[C@H]1CNCCC1(F)F

IUPAC: tert-butyl N-[(3S)-4,4-difluoropiperidin-3-yl]carbamate

InChI: InChI=1S/C10H18F2N2O2/c1-9(2,3)16-8(15)14-7-6-13-5-4-10(7,11)12/h7,13H,4-6H2,1-3H3,(H,14,15)/t7-/m0/s1

Composition: C (50.84%), H (7.68%), F (16.08%), N (11.86%), O (13.54%)

Molar Mass: 236.263

Atom Count: 34

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	236.133634154
Formal Charge	0
FSP3	0.9
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	PQJOHBZTOIMHCM-ZETCQYMHSA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.34
Topological Polar Surface Area	50.36
Polarizability	21.43
Ring Count	1
Rotatable Bond Count	3

Suppliers

Shanghai AQ BioPharma Co., Ltd.

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<8 Days	2089321-16-2		$571.43-$8,228.57$571.43$1,714.29$2,742.86$5,142.86$8,228.57