Structural formula
Business number | 0531 |
---|---|
Molecular formula | C13H17HgNO6 |
Molecular weight | 483.90 |
label |
Salyrganic acid, 2-[N-(3-Hydroxymercuri-2-methoxypropyl)carbamoyl]phenoxyacetic acid, 2-(3-Hydroxymercurio-2-methoxypropylcarbamoyl)phenoxyacetic acid, HOHgCH2CH(OCH3)CH2NHCOC6H4OCH2CO2H |
Numbering system
CAS number:486-67-9
MDL number:MFCD00004302
EINECS number:207-637-5
RTECS number:None
BRN number:None
PubChem ID:None
Physical property data
1. Character: Undetermined
2. Density (g/ m3,25/4℃): Undetermined
3. Relative vapor density (g/cm3, Air =1): Undetermined
4. Melting point (ºC):12-193
5. Boiling point (ºC,Normal pressure): Undetermined
6. Boiling point (ºC,5.2kPa): Undetermined
7. Refractive index: Undetermined
8. Flash Point (ºC): Undetermined
9. Specific optical rotation (º): Undetermined
10. Autoignition point or ignition temperature (ºC): Undetermined
11. Vapor pressure (kPa,25ºC): Undetermined
12. Saturated vapor pressure (kPa,60ºC): Undetermined
13. Heat of combustion (KJ/mol): Undetermined
14. Critical temperature (ºC): Undetermined
15. Critical pressure (KPa): Undetermined
16. Oil and water (octanol/Log value of water) partition coefficient: Undetermined
17. Explosion limit (%,V/V): Undetermined
18. Lower explosion limit (%,V/V): Undetermined
19. Solubility: Undetermined
Toxicological data
None
Ecological data
This substance may be harmful to the environment, and special attention should be paid to water bodies.
Molecular structure data
1、 Molar refractive index:67.97
2、 Molar volume(m3/mol):176.1
3、 Isotonic specific volume (90.2K):506.1
4、 Surface tension(dyne/cm):68.2
5、 Polarizability(10-24cm3):26.94
Compute chemical data
1. Hydrophobic parameters Calculate the reference value (XlogP): Undetermined
2. Hydrogen Bonding Number of donors: 3
3. Hydrogen Bonding Number of receptors: 6
4. Rotatable Number of chemical bonds: 9
5. Interchange Number of isomers: 2
6. Topological molecules Polar surface area (TPSA):85.9
7. Heavy Atom Quantity: 21
8. Surface Charge :0
9. Complexity :328
10. Isotope atomic number:0
11. Determine the number of atomic stereocenters:0
12. Uncertain number of atomic stereocenters1
13. Determine the number of stereocenters of chemical bonds:0
14. Uncertain number of chemical bond stereocenters:0
15. Number of covalent bond units: 2
Properties and stability
Use and store according to specifications, no decomposition will occur, and avoid contact with oxides
Storage method
Save in a sealed manner, placed in a ventilated, dry place, and avoid contact with other oxides.
Synthesis method
None
Purpose
None