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Molecule
Sodium Metaborate
CAS: 7775-19-1 · HBNaO2
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 7775-19-1
- Molecular Formula
- HBNaO2
- Molecular Mass
- 66.81 g/mol
Identifiers
CAS Registry Number
7775-19-1
SMILES
O=BO.[Na]
InChI Key
LJKPPVHAMRFFOZ-UHFFFAOYSA-N
InChI
InChI=1S/BHO2.Na/c2-1-3;/h2H;
Names and Synonyms
- Sodium Metaborate Common Name
- Boric acid (HBO2), sodium salt (1:1) Synonym
- Boric acid (HBO2), sodium salt Synonym
- Sodium borate (NaBO2) Synonym
- Borosoap Synonym
- Sodium metaborate Synonym
- Kodalk Synonym
- Sodium metaborate (NaBO2) Synonym
- Monosodium metaborate Synonym
- Sodium borate (Na2(BO2)2) Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 66.81 g/mol | CAS Common Chemistry |
| 66.996728952 g/mol | RDKit | |
| 66.808 g/mol | RDKit | |
| 67.814 g/mol | chempirical lib | |
| Density | 2.46 g/cm³ | CAS Common Chemistry |
| 2.464 g/cm3 | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Sodium_metaborate | CAS Common Chemistry |
| Boiling Point | 1434 °C | CAS Common Chemistry |
| Canonical SMILES | [Na].O=BO | CAS Common Chemistry |
| InChI | InChI=1S/BHO2.Na/c2-1-3;/h2H; | CAS Common Chemistry |
| InChI Key | InChIKey=LJKPPVHAMRFFOZ-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 966 °C | CAS Common Chemistry |
| Name | Sodium metaborate | CAS Common Chemistry |
| Heavy Atom Count | 4 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 37.3 Ų | RDKit |
| LogP | -1.4374000000000002 | RDKit |
| -1.4374 | RDKit | |
| Molar Refractivity | 14.4133 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 66.808 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
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.
External Resources
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MW = 66.81 g/mol; density = 2.460 g/mL. Edit any field — others recompute live.
