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pipes disodium salt

HCID 173553
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Basic information

CAS
76836-02-7
Standard SMILES
O=S(=O)([O-])CCN1CCN(CCS(=O)(=O)[O-])CC1.[Na+].[Na+]
InChIKey
GMHSTJRPSVFLMT-UHFFFAOYSA-L
Molecular formula
C8H16N2Na2O6S2
Average molar mass
346.3 g/mol
Monoisotopic mass
346.02451715

Overview

Disodium PIPES is an organic salt, being the disodium salt of 2,2'-piperazine-1,4-diylbisethanesulfonic acid (PIPES), a buffering agent. It has a role as a buffer. It contains a 2,2'-piperazine-1,4-diylbisethanesulfonate.

Names & identifiers

Preferred name
pipes disodium salt
IUPAC
disodium;2-[4-(2-sulfonatoethyl)piperazin-1-yl]ethanesulfonate
English name
Disodium piperazine-1,4-diethanesulphonate
Molecular formula
C8H16N2Na2O6S2
Molecular weight
346.33

Names & synonyms

76836-02-7PIPES disodium salt1,4-Piperazinediethanesulfonic acid, disodium saltpipes disodiumDisodium piperazine-1,4-diethanesulphonateSODIUM PIPESATEO25162TU3UEINECS 278-562-31,4-Piperazinediethanesulfonic acid, sodium salt (1:2)DTXSID1072844PIPES DISODIUM SALT [MI]DISODIUM 1,4-PIPERAZINEBIS(ETHANESULFONATE)
Show more names
PIPES 2NAPIPES-NA2Piperazine-1isodiumPIPESPIPES NA2-SALTdisodium PIPESMAGNESIUM STANDPOTASSIUM STANDSTRONTIUM STAND
Piperazine1,4bis(2ethanesulfonic acid) disodium saltPiperazine, N,N'bis(2ethanesulfonic acid) disodium saltRefChem:863630DTXCID3047922Disodium piperazine1,4diethanesulphonate1,4Piperazinediethanesulfonic acid, disodium salt1,4Piperazinediethanesulfonic acid, sodium salt (1:2)1,4-Piperazinediethanesulfonic acid disodium salt

Properties

Computed structural properties

Topological polar surface area
138 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
4
Heavy atoms
20
Formal charge
0
Complexity
370

Experimental & physicochemical properties

Chemical ClassesOther Uses -> Biological Buffers
Physical DescriptionSolid; [Sigma-Aldrich MSDS]

Physicochemical properties

Density
1.72 · 1.72[at 20℃]
vapor pressure
0 Pa · 0Pa at 20℃
storage temp.
Inert atmosphere,Room Temperature
solubility
2 O: · H2O: 0.5 g/mL, clear, colorless
form
Powder or Crystalline Powder
color
White
PH Range
6.1 · 6.1 - 7.5
pka
6.8 · 6.8(at 25℃)
PH
6.1 · 6.1-7.5
biological source
synthetic
Water Solubility
855 g/L · 855g/L at 19.8℃
Merck
14 · 14,7479
BRN
9453872 · 9453872

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 3 items

This chemical does not meet GHS hazard criteria for 96% (48 of 50) of all reports.

Not Classified

Aggregated GHS information provided per 50 reports by companies from 3 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory Information · 3 items

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

REACH registered substance: Disodium piperazine-1,4-diethanesulphonate (EC: 278-562-3)

1,4-Piperazinediethanesulfonic acid, disodium salt: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazards SummaryMay cause irritation; [Sigma-Aldrich MSDS]
Hazard Classes and CategoriesNot Classified

Safety data

PPE
Eyeshields, Gloves, type N95 (US)
wgk
3
tsca
TSCA listed
hs_code
29335995
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code
26-37/39-24/25
Storage Class
11 - Combustible Solids

Chemistry & industry

Uses & manufacturing

UsesUsed as a biological buffer; [Merck Index]
General Manufacturing Information1,4-Piperazinediethanesulfonic acid, sodium salt (1:2): ACTIVE
Applications · 2 items

UsesPIPES Disodium is the sodium salt form of PIPES and is a biological buffer often referred to as a “Good′s” buffer. The pKa of PIPES is 6.8 which makes it ideal for biological applications at physiological conditions. PIPES Disodium is considered to be non-toxic to culture cell lines, highly water soluble and provides high-solution clarity.PIPES Disodium can be used in a wide array of biological applications including as a component in media formulations. Specific applications include buffers for cell culture and diagnostic reagent production.

UsesBiological buffer.

Additional notes

DefinitionChEBI: An organic salt, being the disodium salt of 2,2'-piperazine-1,4-diylbisethanesulfonic acid (PIPES), a buffering agent.

Related reactions

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Compound notes

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Database identifiers

CAS
76836-02-7
PubChem CID
173553
DTXSID
DTXSID1072844
ChEBI
CHEBI:63055
UNII
O25162TU3U
EC Number
278-562-3
Nikkaji
J208.883E
Major Application
diagnostic assay manufacturing
InChI
1S/C8H18N2O6S2.2Na/c11-17(12,13)7-5-9-1-2-10(4-3-9)6-8-18(14,15)16;;/h1-8H2,(H,11,12,13)(H,14,15,16);;/q;2*+1/p-2
InChIKey
GMHSTJRPSVFLMT-UHFFFAOYSA-L
SMILES
[Na+].[Na+].[O-]S(=O)(=O)CCN1CCN(CC1)CCS([O-])(=O)=O
LogP
-6 at · -6 at 20℃
CAS DataBase Reference
76836 · 76836-02-7(CAS DataBase Reference)
FDA UNII
25162 TU3U · O25162TU3U
EPA Substance Registry System
1 · 1,4-Piperazinediethanesulfonic acid, disodium salt (76836-02-7)
UNSPSC Code
12161700 · 12161700
NACRES
25 · NA.25
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P305+P351+P338
PPE
95 · Eyeshields, Gloves, type N95 (US)
Hazard Codes
Xi
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-37/39-24/25
WGK Germany
3 · 3
TSCA
TSCA listed
HS Code
29335995 · 29335995
Storage Class
11 · 11 - Combustible Solids
REACH Registrations
Active
Hazard statements
H302-H315-H319-H335
REACH Registrations
Active
Precautionary statements
P261-P305+P351+P338