2-(N-Morpholino)ethanesulfonic acid potassium

C6H12KNO4SCAS 39946-25-3233.32 g/mol

Open in Covalent MOL file
O−SOONOK+
EtherSulfonic acidTertiary amine

Properties

Molecular formula
C6H12KNO4S
Molar mass
233.32 g/mol
Exact mass
233.0124 Da
logP
-1.17Crippen estimate
Polar surface area
66.8 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
3

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
39946-25-3
SMILES
[O-]S(=O)(=O)CCN1CCOCC1.[K+]
InChI

The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.

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Names and synonyms

2 names
  • 4-Morpholineethanesulfonic acid, potassium salt (1:1)
  • 4-Morpholineethanesulfonic acid, potassium salt

Work with 2-(N-Morpholino)ethanesulfonic acid potassium

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

2-(N-Morpholino)ethanesulfonic acid hydrate145224-94-8Hydrate Mes (buffer)4432-31-9Free acid Sodium 2-(N-morpholino)ethanesulfonate71119-23-8Salt

Similar compounds

Dipotassium piperazine-1,4-bis(2-ethanesulfonate)108321-27-374 % similar 3-(N-Morpholino)propanesulfonic acid sodium salt71119-22-764 % similar Sodium pipesate76836-02-757 % similar Sodium 2-(bis(2-hydroxyethyl)amino)ethane-1-sulfonate66992-27-649 % similar Sodium HEPES75277-39-347 % similar Sodium 1,4-piperazinediethanesulfonate (3:2)100037-69-246 % similar Sodium 1,4-piperazinediethanesulfonate (1:1)10010-67-046 % similar Mopso sodium salt79803-73-944 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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