4-(piperazin-1-yl)benzoic acid dihydrochloride

4-(piperazin-1-yl)benzoic acid dihydrochloride

Formula: C11H16Cl2N2O2

SMILES: Cl.Cl.OC(=O)C1=CC=C(C=C1)N1CCNCC1

IUPAC: 4-(piperazin-1-yl)benzoic acid dihydrochloride

InChI: InChI=1S/C11H14N2O2.2ClH/c14-11(15)9-1-3-10(4-2-9)13-7-5-12-6-8-13;;/h1-4,12H,5-8H2,(H,14,15);2*1H

Composition: C (47.33%), H (5.78%), Cl (25.40%), N (10.04%), O (11.46%)

Molar Mass: 279.16

Atom Count: 33

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	278.0588832
Formal Charge	0
FSP3	0.36
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	JIEHDSDPUDKDLX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.5
Topological Polar Surface Area	52.57
Polarizability	21.96
Ring Count	2
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C11H16Cl2N2O2		Quote Only