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2-[4-(2-Hydroxyethyl)piperazin-4-ium-1-yl]ethanesulfonate

HCID 23830
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
7365-45-9
Standard SMILES
O=S(=O)([O-])CCN1CC[NH+](CCO)CC1
InChIKey
JKMHFZQWWAIEOD-UHFFFAOYSA-N
Molecular formula
C8H18N2O4S
Average molar mass
238.31 g/mol
Monoisotopic mass
238.09872823

Overview

2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]ethanesulfonate is a HEPES that is ethanesulfonate substituted by a 4-(2-hydroxyethyl)piperazin-4-ium-1-yl group at position 2. It is a conjugate acid of a 2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanesulfonate. It is a tautomer of a 2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanesulfonic acid.

Names & identifiers

Preferred name
2-[4-(2-Hydroxyethyl)piperazin-4-ium-1-yl]ethanesulfonate
IUPAC
2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]ethanesulfonate
English name
HEPES
Molecular formula
C8H18N2O4S
Molecular weight
238.3

Names & synonyms

2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]ethanesulfonateBRN 08830432-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]ethanesulfonateN-2-Hydroxyethylpiperazine-N -2-ethanesulfonic acidbmse000202bmse000792bmse000877bmse000890CHEBI:46755AKOS025243245HEPES BUFFER4-(2-HYDROXYETHYL)-1-PIPERAZINEETHANESULFONIC ACID
Show more names
HYDROXYETHYLPIPERAZINE ETHANE SULFONIC ACID4-(2-HYDROXYETHYL)PIPERAZINE-1-ETHANESULFONIC ACIDhepes solutionBiological BufferHEPES buffer SolutionEPES4-(2-hydroxyethyl)piperazin-1-ylethanesulphonic acid2-[4-(2-HYDROXYETHYL)-1-PIPERAZINYL]ETHANESULFONIC ACID

Database identifiers

CAS
7365-45-9
PubChem CID

Properties

Computed structural properties

XLogP
-4.1
Topological polar surface area
93.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
15
Formal charge
0
Complexity
254

Physicochemical properties

Melting point
234 · 234-238 °C
Boiling point
408 ℃[at · 408℃[at 101 325 Pa]
bulk density
560 kg/m3 · 560kg/m3
Density
1.07 g/mL · 1.07 g/mL at 20 °C
vapor pressure
0 Pa · 0Pa at 25℃
refractive index
20 · n20/D 1.339
storage temp.
2 · 2-8°C
solubility
2 O: · H2O: 1 M at 20 °C, clear, colorless
form
powder
color
White
PH
5 · 5.0-6.5 (1Maqueous solution)
pka
7.5 · 7.5(at 25℃)
PH Range
7 · 7.0 - 7.6
biological source
synthetic
Water Solubility
Soluble
λmax
260 nm · λ: 260 nm Amax: 0.06λ: 280 nm Amax: 0.04
Merck

Safety & regulation

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

Safety data

PPE
Eyeshields, Gloves, type N95 (US)
wgk
1
tsca
TSCA listed
rtecs
TL6809000
hs_code
29335995
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code
24/25-22-36-26
Storage Class
13 - Non Combustible Solids
Hazard statements
H302-H315-H319-H335
REACH Registrations
Active
Precautionary statements
P261-P271-P280

Chemistry & industry

Applications · 5 items

DescriptionHEPES has been described as one of the best all-purpose buffers available for biological research. At biological pH, the molecule is zwitterionic, and is effective as a buffer at pH 6.8 to 8.2 (pKa 7.55). It is typically used in cell culture at concentration between 5mM to 30 mM. HEPES has been used in a wide variety of applications, including tissue culture. It is commonly used to buffer cell culture media in air. HEPES finds its usage in in vitro experiments on Mg.

UsesNon-toxic to cell. It is used as a hydrogen ion buffer, which can control the constant pH range for long term. The concentration is 10-50mmol/L. Generally, 20mmol/LHEPES in nutrient solution can get buffer ability.

UsesHEPES is common buffer for biological sciences, particularly used in cell culture to maintain physiological pH. It acts a buffering component, which is used in the preparation of buffers. It is described as one of the best all-purpose buffers available for use in biological research.HEPES has been used as a component of:Hank′s balanced salt solution, Dulbecco′s modified eagle′s medium and no-glucose DMEM, which are used for the preparation of tissue slices.Buffers used in localized conductance measurements on the basolateral side of culture inserts to examine cation selectivity.

UsesHEPES is a biological buffer. It may be used in isoelectric focusing applications and as a buffer in the quantitative and selective measurement of antigen-antibody reactions. HEPES is reportedly superior to NaHCO3 in controlling pH in tissue and organ culture. HEPES is not recommended for use with the Folin-Ciocalteu protein assay.

General DescriptionHEPES buffered saline is a tissue culture buffer, which is used to maintain the pH of cell culture. It is water soluble and atmosphere independent. HEPES destroys magnesium in sodium chloride solutions.

Upstream & downstream products

Upstream raw materials

1-(2-Hydroxyethyl)piperazineSodium isethionate

Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
23830
ChEBI
CHEBI:46755
Nikkaji
J3.334.021D
14 · 14,4654
BRN
883043 · 883043
Stability
Stable. Combustible. Incompatible with strong oxidizing agents. Protect from moisture.
Major Application
diagnostic assay manufacturing
Cosmetics Ingredients Functions
BUFFERING
InChI
1S/C8H18N2O4S/c11-7-5-9-1-3-10(4-2-9)6-8-15(12,13)14/h11H,1-8H2,(H,12,13,14)
InChIKey
JKMHFZQWWAIEOD-UHFFFAOYSA-N
SMILES
OCCN1CCN(CC1)CCS(O)(=O)=O
LogP
-3.85 at · -3.85 at 20℃
CAS DataBase Reference
7365 · 7365-45-9(CAS DataBase Reference)
EWG's Food Scores
1 · 1
FDA UNII
266 YE9I · RWW266YE9I
EPA Substance Registry System
1 · 1-Piperazineethanesulfonic acid, 4-(2-hydroxyethyl)- (7365-45-9)
Absorption
0.05 at · ≤0.05 at 290 in H2O at 33%
UNSPSC Code
41116107 · 41116107
NACRES
75 · NA.75
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P271-P280
PPE
95 · Eyeshields, Gloves, type N95 (US)
Hazard Codes
Xi
Risk Statements
36 · 36/37/38
Safety Statements
24 · 24/25-22-36-26
WGK Germany
1 · 1
RTECS
6809000 · TL6809000
TSCA
TSCA listed
HS Code
29335995 · 29335995
Storage Class
13 · 13 - Non Combustible Solids
REACH Registrations
Active

Suppliers100 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]
北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
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杭州品高化工有限公司0571-87658025 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
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大连美仑生物技术有限公司0411-62910999 13889544652 · [email protected]
阿法埃莎(中国)化学有限公司400-6106006 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
Pure Chemistry Scientific Inc.001-857-928-2050 or 1-888-588-9418 · [email protected]
上海泰坦科技股份有限公司4006009262 13023226327 · [email protected]
上海隆盛化工有限公司58099637 13585536065 · [email protected]
武汉赛沃尔化工有限公司027-85613400 18707177243 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [email protected]
孝感深远化工有限公司15527621225; 15527621225 · [email protected]
唐山默内德贸易有限公司0315-8309571 15633399667 · [email protected]
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
四川库利南科技有限公司400-1166-196 18981987031 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
湖南汇百侍生物科技有限公司0731-85526065 13308475853 · [email protected]
斯百全化学(上海)有限公司021-021-021-67601398-809-809-809 15221380277 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
南京爱莉生物科技有限公司025-83208295 18913388297 · [email protected]
上海思域化工科技有限公司86-21-34053660 · [email protected]
赛默飞世尔科技(中国)有限公司800-810-5118 · [email protected]
北京伊诺凯科技有限公司400-810-7969 010-59572699 · [email protected]
Wuhan NCE Biomedical Co.,Ltd.4000-027-021 |24 +86-13986109188 | +86-15623472865 | +81-08033611988
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上海贤鼎生物科技有限公司4009209199 · [email protected]
Advent Bio, Inc.(630) 889-9003 · [email protected]
南京杜莱生物技术有限公司025-84699383-8003;025-846993838003-8003 18013301590 · [email protected]
上海倍卓生物科技有限公司021-61119791,13386096464 · [email protected]
上海将来实业股份有限公司400-0066400 13621662912 · [email protected]
上海将来实业股份有限公司021-61552785 · [email protected]

Additional notes

DefinitionChEBI: A HEPES that is ethanesulfonate substituted by a 4-(2-hydroxyethyl)piperazin-4-ium-1-yl group at position 2.