Australian Solanium Solasodine

Structural formula

• Numbering system
• Physical property data
• Toxicological data
• Ecological data
• Molecular structure data
• Computing chemical data
• More
  • Properties and Stability
  • Storage method
  • Synthesis method
  • Purpose

Numbering system

CAS number:126-17-0

MDL number:None

EINECS number:None

RTECS number:None

BRN number:None

PubChem ID:None

Physical property data

None

Toxicological data

None

Ecological data

None

Molecular structure data

1. Molar refractive index: 121.27

2. Molar volume (cm³/mol): 368.3

3. Isotonic specific volume (90.2K ): 956.8

4. Surface tension (dyne/cm): 45.5

5. Polarizability (10^-24cm³): 48.07

Compute chemical data

1. Hydrophobic parameter calculation reference value (XlogP): 5.4

2. Number of hydrogen bond donors: 2

3. Number of hydrogen bond acceptors: 3

4. Number of rotatable chemical bonds: 0

5. Number of tautomers:

6. Topological molecular polar surface area (TPSA): 41.5

7. Number of heavy atoms: 30

8. Surface charge: 0

9. Complexity: 749

10. Number of isotope atoms: 0

11. Determine the number of atomic stereocenters: 11

12. Uncertain number of atomic stereocenters: 0

13. Determine the number of chemical bond stereocenters Number: 0

14. Number of uncertain chemical bond stereocenters: 0

15. Number of covalent bond units: 1

Properties and stability

None

Storage method

None

Synthesis method

None

Purpose

None