2-(piperazin-1-yl)butanedioic acid

2-(piperazin-1-yl)butanedioic acid

CAS: 70920-57-9

Formula: C8H14N2O4

SMILES: OC(=O)CC(N1CCNCC1)C(O)=O

IUPAC: 2-(piperazin-1-yl)butanedioic acid

InChI: InChI=1/C8H14N2O4/c11-7(12)5-6(8(13)14)10-3-1-9-2-4-10/h6,9H,1-5H2,(H,11,12)(H,13,14)

Composition: C (47.52%), H (6.98%), N (13.85%), O (31.65%)

Molar Mass: 202.21

Atom Count: 28

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	202.095356939
Formal Charge	0
FSP3	0.75
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	3
InChIKey	GVRXFKQNZUWVAF-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.36
Topological Polar Surface Area	89.87
Polarizability	18.95
Ring Count	1
Rotatable Bond Count	4

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95%	<2 Days	70920-57-9		$134.76$134.76