tert-butyl N-{[1-(2-chloroacetyl)piperidin-4-yl]methyl}carbamate

tert-butyl N-{[1-(2-chloroacetyl)piperidin-4-yl]methyl}carbamate

Formula: C13H23ClN2O3

SMILES: CC(C)(C)OC(=O)NCC1CCN(CC1)C(=O)CCl

IUPAC: tert-butyl N-{[1-(2-chloroacetyl)piperidin-4-yl]methyl}carbamate

InChI: InChI=1S/C13H23ClN2O3/c1-13(2,3)19-12(18)15-9-10-4-6-16(7-5-10)11(17)8-14/h10H,4-9H2,1-3H3,(H,15,18)

Composition: C (53.70%), H (7.97%), Cl (12.19%), N (9.63%), O (16.51%)

Molar Mass: 290.79

Atom Count: 42

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	290.1397203
Formal Charge	0
FSP3	0.85
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	SUVQUXXXBLWSSK-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	74.09
Topological Polar Surface Area	58.64
Polarizability	28.96
Ring Count	1
Rotatable Bond Count	5

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C13H23ClN2O3		Quote Only