chempirical

Mops

C7H15NO4SCAS 1132-61-2209.26 g/mol

Open in Covalent MOL file
OSOHONO
EtherSulfonic acidTertiary amine

Properties

Molecular formula
C7H15NO4S
Molar mass
209.26 g/mol
Exact mass
209.0722 Da
Melting point
284 °C
logP
-0.40Crippen estimate
Polar surface area
66.8 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
4

Identifiers

CAS number
1132-61-2
SMILES
O=S(=O)(O)CCCN1CCOCC1
InChIKey
DVLFYONBTKHTER-UHFFFAOYSA-N
InChI
InChI=1S/C7H15NO4S/c9-13(10,11)7-1-2-8-3-5-12-6-4-8/h1-7H2,(H,9,10,11)

Weigh it out

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

Names and synonyms

8 names
  • 4-Morpholinepropanesulfonic acid
  • Morpholinopropanesulfonic acid
  • 3-Morpholinopropanesulfonic acid
  • 3-(N-Morpholino)propanesulfonic acid
  • WAS 15
  • 3-(4-Morpholino)propanesulfonic acid
  • 3-Morpholin-4-ium-4-ylpropane-1-sulfonate
  • 3-Morpholin-4-yl-propane-1-sulfonic acid

Work with Mops

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

Similar compounds

Mes (buffer)4432-31-978 % similar 4-Morpholineethanesulfonic acid hydrate (1:1)145224-94-870 % similar Hepps (buffer)16052-06-561 % similar Pipes5625-37-654 % similar 3-(N-Morpholino)propanesulfonic acid sodium salt71119-22-751 % similar 1,3-Propanedisulfonic acid21668-77-950 % similar 1,4-Butanedisulfonic acid27665-39-050 % similar 2-Hydroxy-3-morpholinopropanesulfonic acid68399-77-950 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia