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Potassium Borohydride
CAS: 13762-51-1 | H4BK
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
13762-51-1
Molecular Formula:
H4BK
Molecular Weight:
53.942 g/mol
Names and Synonyms:
Potassium Borohydride
Synonym
Borate(1-), tetrahydro-, potassium (1:1)
Synonym
Borate(1-), tetrahydro-, potassium
Synonym
Potassium tetrahydroborate
Synonym
Potassium borohydride
Synonym
Potassium tetrahydroborate(1-)
Synonym
Potassium borohydride (KBH4)
Synonym
Potassium tetrahydroborate (KBH4)
Synonym
Identifiers:
SMILES:
[BH4-].[K+]
InChI:
InChI=1S/BH4.K/h1H4;/q-1;+1
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 |
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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 | 53.942 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 54.004312207999995 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 2 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 0 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 0 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 0.0 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | -4.4475999999999996 | RDKit |
| molecular_mass | 53.94 g/mol | Legacy Database |
| cas-canonical-smile | [K+].[H-][B+3]([H-])([H-])[H-] None | Legacy Database |
| cas-inchi | InChI=1S/BH4.K/h1H4;/q-1;+1 None | Legacy Database |
| cas-inchi-key | InChIKey=ICRGAIPBTSPUEX-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 500 °C (decomp) None | Legacy Database |
| cas-name | Potassium borohydride None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 11.333999999999998 | RDKit |