sodium α-naphthylacetate sodium α-naphthylacetate

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:61-31-4

mdl number:none

einecs number:200-504-2

rtecs number:qj1355000

brn number:none

pubchem id:none

physical property data

appearance: white crystalline powder.

toxicological data

1, acute toxicity: mouse oral ld50: 670mg/kg
toxic

ecological data

none yet

molecular structure data

none yet

compute chemical data

1. reference value for hydrophobic parameter calculation (xlogp): none

2. number of hydrogen bond donors: 0

3. number of hydrogen bond acceptors: 2

4. number of rotatable chemical bonds: 2

5. number of tautomers: none

6. topological molecule polar surface area 40.1

7. number of heavy atoms: 15

8. surface charge: 0

9. complexity: 218

10. number of isotope atoms: 0

11. determine the number of atomic stereocenters: 0

12. uncertain number of atomic stereocenters: 0

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

none yet

storage method

keep sealed.

synthesis method

none yet

purpose

organic synthesis