eprodisate CAS 21668-77-9

Details:

Density 1.8± 0.1g /cm3
Melting point 120-124ºC
Molecular formula C3H8O6S2
Molecular weight 204.222
Accurate mass 203.976227
PSA 125.50000
LogP minus 3.47
Appearance character liquid; Colorless to Light yellow clear liquid
Refractive index 1.549
Storage condition
Keep the cache sealed

Store in a tight container in a cool, dry place

stability
It will not decompose if used and stored according to specifications

Avoid contact with oxides, alkalis

Molecular structure
1. Molar refractive index: 36.63

2, molar volume (m3/mol) : 115.1

3. Isotropic volume (90.2K) : 351.3

4. Surface tension (dyne/cm) : 86.7

5. Polarization (10-24cm3) : 14.52

Computational chemistry
1. Reference value for calculating hydrophobic parameters (XlogP) :-1.6

2. Number of hydrogen bond donors :2

3. Number of hydrogen bond receptors :6

4. Number of rotatable bonds :4

5. Number of tautomers: None

6. Topological molecular polar surface area 126

7. Number of heavy atoms :11

8. Surface charge :0

9. Complexity :254

10. Number of isotope atoms :0

11. Determine the number of primary constitutive centers :0

12. Number of indeterminate atomic orthotropic centers :0

13. Determine the number of chemical bond constitutive centers :0

14. Number of uncertain bond constitutive centers :0

15. Number of covalent bond units :1

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