2-Hydroxy-3-morpholinopropanesulfonic acid

C₇H₁₅NO₅SCAS 68399-77-9225.26 g/mol

Open in Covalent MOL file

Alcohol Ether Sulfonic acid Tertiary amine

Properties

Molecular formula: C₇H₁₅NO₅S
Molar mass: 225.26 g/mol
Exact mass: 225.0671 Da
logP: -1.43Crippen estimate
Polar surface area: 87.1 Å²
H-bond donors / acceptors: 2 / 5
Rotatable bonds: 4

Hazards

Warning

H315 Causes skin irritation99% of notifiers
H319 Causes serious eye irritation99% of notifiers
H335 May cause respiratory irritation97.9% of notifiers

Aggregated from 96 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

68399-77-9

SMILES

O=S(=O)(O)CC(O)CN1CCOCC1

InChIKey

NUFBIAUZAMHTSP-UHFFFAOYSA-N

InChI

InChI=1S/C7H15NO5S/c9-7(6-14(10,11)12)5-8-1-3-13-4-2-8/h7,9H,1-6H2,(H,10,11,12)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

11 names

4-Morpholinepropanesulfonic acid, β-hydroxy-
β-Hydroxy-4-morpholinepropanesulfonic acid
3-(N-Morpholino)-2-hydroxypropanesulfonic acid
MOPSO
(±)-2-Hydroxy-3-morpholinopropanesulfonic acid
3-Morpholino-2-hydroxypropanesulfonic acid
3-(N-Morpholinyl)-2-hydroxypropanesulfonic acid
2-Hydroxy-3-morpholin-4-ylpropane-1-sulfonic acid
2-Hydroxy-3-morpholin-4-yl-propane-1-sulfonic acid
2-Hydroxy-3-(morpholin-4-yl)propane-1-sulfonic acid
2-Hydroxy-4-morpholinepropanesulphonic acid

Work with 2-Hydroxy-3-morpholinopropanesulfonic acid

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.

Mopso sodium salt79803-73-9Salt

Similar compounds

Piperazine-N,N′-bis(2-hydroxypropanesulfonic acid)68189-43-577 % similar 3-[Bis(2-hydroxyethyl)amino]-2-hydroxypropanesulfonic acid68399-80-468 % similar N-2-Hydroxyethylpiperazine-N′-2-hydroxypropanesulfonic acid68399-78-064 % similar Mes (buffer)4432-31-953 % similar MOPS1132-61-250 % similar 2-(N-Morpholino)ethanesulfonic acid hydrate145224-94-849 % similar α-Methyl-4-morpholineethanol2109-66-242 % similar CAPSO73463-39-539 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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