chempirical

Potassium acid saccharate

C6H9KO8CAS 576-42-1248.23 g/mol

Open in Covalent MOL file
O−OOHOHOHOHOOHK+
AlcoholCarboxylic acid

Properties

Molecular formula
C6H9KO8
Molar mass
248.23 g/mol
Exact mass
247.9934 Da
logP
-3.78Crippen estimate
Polar surface area
155.5 Ų
H-bond donors / acceptors
6 / 6
Rotatable bonds
5
Stereocentres
S, S, S, Rin SMILES atom order

Identifiers

CAS number
576-42-1
SMILES
[O-]C(=O)[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C(=O)O.[K+]
InChIKey
AHPUWJRVCCLSPB-SBBOJQDXSA-N
InChI
InChI=1S/C6H10O8.K/c7-1(3(9)5(11)12)2(8)4(10)6(13)14;/h1-4,7-10H,(H,11,12)(H,13,14);/t1-,2-,3-,4+;/m0./s1

Weigh it out

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

Names and synonyms

9 names
  • D-Glucaric acid, potassium salt (1:1)
  • Glucaric acid, monopotassium salt, D-
  • D-Glucaric acid, monopotassium salt
  • Potassium bisaccharate
  • Potassium hydrogen saccharate
  • D-Saccharic acid monopotassium salt
  • Monopotassium D-glucarate
  • Potassium hydrogen D-glucarate
  • Monopotassium saccharate

Work with Potassium acid saccharate

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

Potassium bitartrate868-14-481 % similar Potassium tartrate921-53-965 % similar Monosodium tartrate526-94-363 % similar Calcium saccharate5793-88-461 % similar Mucic acid526-99-860 % similar Saccharic acid87-73-060 % similar Potassium gluconate299-27-459 % similar Potassium sodium tartrate304-59-659 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook