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Potassium Lactate
CAS: 996-31-6 | C3H6KO3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
996-31-6
Molecular Formula:
C3H6KO3
Molecular Weight:
129.176 g/mol
Names and Synonyms:
Potassium Lactate
Slack potassium
Purasal P
Purasel P
E 326
Potassium DL-lactate
Conclyte K
Potassium α-hydroxypropionate
Propanoic acid, 2-hydroxy-, monopotassium salt
Potassium lactate
Lactic acid, monopotassium salt
Propanoic acid, 2-hydroxy-, potassium salt (1:1)
Identifiers:
SMILES:
CC(O)C(=O)O.[K]
InChI:
InChI=1S/C3H6O3.K/c1-2(4)3(5)6;/h2,4H,1H3,(H,5,6);
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 129.176 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 128.995400732 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 7 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 2 count | RDKit |
| Hydrogen Bond Donors | 2 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 1 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 57.53 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | -0.929 | RDKit |
| molecular_mass | 129.18 g/mol | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Potassium_lactate None | Legacy Database |
| cas-canonical-smile | [K].O=C(O)C(O)C None | Legacy Database |
| cas-inchi | InChI=1S/C3H6O3.K/c1-2(4)3(5)6;/h2,4H,1H3,(H,5,6); None | Legacy Database |
| cas-inchi-key | InChIKey=BYPIKLIXBPMDBY-UHFFFAOYSA-N None | Legacy Database |
| cas-name | Potassium lactate None | Legacy Database |
| wikipedia-name | Potassium lactate None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 25.070599999999995 | RDKit |
