piperacillin

(2S,5R,6R)-6-[[(2R)-2-[(4-ethyl-2,3-dioxopiperazine-1-carbonyl)amino]-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

CAS: 61477-96-1

Molecular Formula	`C23H27N5O7S`
Molecular Weight	517.6 g/mol
LogP	0.5
Topological Polar Surface Area	182.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	8
Rotatable Bonds	6
Exact Mass	517.16315
Heavy Atoms	36
Complexity	982.0

Chemical Identifiers

CAS Number	61477-96-1
SMILES	`CCN1CCN(C(=O)C1=O)C(=O)NC(C2=CC=CC=C2)C(=O)NC3C4N(C3=O)C(C(S4)(C)C)C(=O)O`
InChIKey	`IVBHGBMCVLDMKU-GXNBUGAJSA-N`

📖 Product Overview

piperacillin (CAS: 61477-96-1) is a chemical compound with molecular formula C23H27N5O7S and molecular weight 517.6 g/mol. Its IUPAC systematic name is (2S,5R,6R)-6-[[(2R)-2-[(4-ethyl-2,3-dioxopiperazine-1-carbonyl)amino]-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid. LogP 0.5 Topological Polar Surface Area 182.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 8 Rotatable Bonds 6 Exact Mass 517.16315 Heavy Atoms 36 Complexity 982.0 InChI Key: IVBHGBMCVLDMKU-GXNBUGAJSA-N. SMILES: CCN1CCN(C(=O)C1=O)C(=O)NC(C2=CC=CC=C2)C(=O)NC3C4N(C3=O)C(C(S4)(C)C)C(=O)O.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.

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