Basic information
- Standard SMILES
O=S(=O)(O)CCN1CCN(CCS(=O)(=O)O)CC1- InChIKey
IHPYMWDTONKSCO-UHFFFAOYSA-N- Molecular formula
- C8H18N2O6S2
- Average molar mass
- 302.4 g/mol
- Monoisotopic mass
- 302.0606283
Overview
2,2'-piperazine-1,4-diylbisethanesulfonic acid is a Good's buffer substance, pKa = 6.8 at 20 C. It is a conjugate acid of a 2,2'-piperazine-1,4-diylbisethanesulfonate.
Names & identifiers
- Preferred name
- Pipes
- IUPAC
- 2-[4-(2-sulfoethyl)piperazin-1-yl]ethanesulfonic acid
Names & synonyms
PIPES5625-37-61,4-Piperazinediethanesulfonic acidPiperazine-N,N'-bis(2-ethanesulfonic acid)1,4-Piperazinebis(ethanesulfonic acid)G502H79V6LNSC-157117EINECS 227-057-6PIPES [MI]NSC 1571172,2'-(Piperazine-1,4-diyl)bis(ethanesulphonic) acidDTXSID8063965
Show more names
RefChem:8636291,4-piperazineethanesulfonateDTXCID5042035CHEBI:390331,4Piperazinediethanesulfonic acid1,4-piperazinediethanesulphonic acid1,4-piperazinediethane sulfonic acid1,4Piperazinebis(ethanesulfonic acid)
Database identifiers
- CAS
5625-37-6- PubChem CID
- 79723
- DTXSID
DTXSID8063965- ChEBI
CHEBI:44933- UNII
- G502H79V6L
- EC Number
- 227-057-6
- Nikkaji
- J8.030F
Properties
Computed structural properties
- XLogP
- -6.7
- Topological polar surface area
- 132 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 397
Experimental & physicochemical properties
Chemical ClassesOther Uses -> Biological Buffers
Physical DescriptionWhite powder; [Alfa Aesar MSDS]
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 96% (72 of 75) of all reports.
Not Classified
Aggregated GHS information provided per 75 reports by companies from 3 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
Chemical: 1,4-Piperazinediethanesulfonic acid
Status: Active Update: 25-08-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/22444
1,4-Piperazinediethanesulfonic acid: Does not have an individual approval but may be used under an appropriate group standard
Hazards SummaryMay cause irritation; [Alfa Aesar MSDS]
Hazard Classes and CategoriesNot Classified
Chemistry & industry
Uses & manufacturing
UsesUsed as a biological buffer; [Merck Index]
General Manufacturing Information1,4-Piperazinediethanesulfonic acid: ACTIVE
Related reactions
4 records
Linked notes
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