tert-butyl 3-(3-chlorophenyl)piperazine-1-carboxylate

tert-butyl 3-(3-chlorophenyl)piperazine-1-carboxylate

CAS: 886767-41-5

Formula: C15H21ClN2O2

SMILES: CC(C)(C)OC(=O)N1CCNC(C1)C1=CC(Cl)=CC=C1

IUPAC: tert-butyl 3-(3-chlorophenyl)piperazine-1-carboxylate

InChI: InChI=1/C15H21ClN2O2/c1-15(2,3)20-14(19)18-8-7-17-13(10-18)11-5-4-6-12(16)9-11/h4-6,9,13,17H,7-8,10H2,1-3H3

Composition: C (60.70%), H (7.13%), Cl (11.94%), N (9.44%), O (10.78%)

Molar Mass: 296.8

Atom Count: 41

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	296.1291556
Formal Charge	0
FSP3	0.53
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	NLCGGRDOWINSEJ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	79.53
Topological Polar Surface Area	41.57
Polarizability	31.47
Ring Count	2
Rotatable Bond Count	3

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