Structural formula
| Business number | 03YF |
|---|---|
| Molecular formula | C4H7NaO3 |
| Molecular weight | 126.09 |
| label |
Sodium beta-hydroxybutyrate, (±)-3-Hydroxybutyric acid sodium salt |
Numbering system
CAS number:150-83-4
MDL number:MFCD00016716
EINECS number:205-774-5
RTECS number:205-774-5
BRN number:4824866
PubChem number:24874713
Physical property data
1. Physical property data: 1. Character: whitePowder 2. Density (g/mL,20℃): Undetermined 3. Relative vapor density (g/mL,Air =1): Undetermined 4. Melting point (ºC): 165-167ºC 5. Boiling point (ºC,normal pressure): Undetermined 6. Refractive index: Undetermined 7. Flashpoint (ºC): Undetermined 8. Specific optical rotation (º): Undetermined 9. Autoignition point or ignition temperature (ºC): Undetermined 10. Vapor pressure (kPa,25ºCUndetermined 11. Saturated vapor pressure (kPa,85ºC): Undetermined 12. Heat of combustion (KJ/mol): Undetermined 13. Critical temperature (ºC):Undetermined 14. Critical pressure (KPa):Undetermined 15. 10.
11. Saturated vapor pressure (kPa,85ºC): Undetermined
12. Heat of combustion (KJ/mol): Undetermined
13. Critical temperature (ºC):Undetermined
14. Critical pressure (KPa):Undetermined
15. Oil and water (octanol/Log value of water) partition coefficient:Undetermined
16. Explosion limit (%,V/V): Undetermined
17. Lower explosion limit (%,V/V): Undetermined
18. Solubility: Undetermined
Toxicological data
None
Ecological data
3. Ecological data:
Usually for Water is not hazardous and materials should not be discharged into the surrounding environment without government permission.
Molecular structure data
None
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond acceptors: 3
4. Number of rotatable chemical bonds: 2
5. Number of tautomers: none
6. Topological molecule polar surface area 60.4
7. Number of heavy atoms: 8
8. Surface charge: 0
9. Complexity: 73.7
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 0
12. Uncertain number of atomic stereocenters: 1
13. Determine the number of chemical bond stereocenters: 0
14. Number of uncertain chemical bond stereocenters: 0
15. Number of covalent bond units: 2
Properties and stability
Stable under normal temperature and pressure.
Storage method
2-8 Store at ºC.
Synthesis method
None
Purpose
None
Arial; mso-font-kerning: 0pt”>Oil and water (octanol /Log value of the partition coefficient of water:Undetermined
16. Explosion limit (%,V/V): Undetermined
17. Lower explosion limit (%,V/V): Undetermined
18. Solubility: Undetermined
Toxicological data
None
Ecological data
3. Ecological data:
Usually for Water is not hazardous and materials should not be discharged into the surrounding environment without government permission.
Molecular structure data
None
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond acceptors: 3
4. Number of rotatable chemical bonds: 2
5. Number of tautomers: none
6. Topological molecule polar surface area 60.4
7. Number of heavy atoms: 8
8. Surface charge: 0
9. Complexity: 73.7
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 0
12. Uncertain number of atomic stereocenters: 1
13. Determine the number of chemical bond stereocenters: 0
14. Number of uncertain chemical bond stereocenters: 0
15. Number of covalent bond units: 2
Properties and stability
Stable under normal temperature and pressure.
Storage method
2-8 Store at ºC.
Synthesis method
None
Purpose
None
i-language: EN-US; mso-fareast-language: ZH-CN; mso-bidi-language: AR-SA”>Stored at ºC.
Synthesis method
None
Purpose
None
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