hydroxy-2-naphthoic acid phenyl ester

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:132-54-7

mdl number:mfcd00014310

einecs number:205-065-0

rtecs number:none

brn number:2217072

pubchem number:24864125

physical property data

none yet

toxicological data

none yet

ecological data

none yet

molecular structure data

5. molecular property data:

1、 molar refractive index:77.62

2、 molar volume(m³/mol): 205.3

3、 isotonic specific volume（90.2k）：563.5

4、 surface tension(3.0 dyne/cm):56.6

5、 polarizability0.5 10^-24 cm³):30.77

compute chemical data

1. reference value for hydrophobic parameter calculation (xlogp): 4.8

2. number of hydrogen bond donors: 1

3. number of hydrogen bond acceptors: 3

4. number of rotatable chemical bonds: 3

5. number of tautomers: 3

6. topological molecule polar surface area 46.5

7. number of heavy atoms: 20

8. surface charge: 0

9. complexity: 335

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: 1

properties and stability

basic properties

white powder. soluble in acetone, insoluble in methanol, insoluble in water.

storage method

none yet

synthesis method

none yet

purpose

none yet

�chemical data

1. reference value for hydrophobic parameter calculation (xlogp): 4.8

2. number of hydrogen bond donors: 1

3. number of hydrogen bond acceptors: 3

4. number of rotatable chemical bonds: 3

5. number of tautomers: 3

6. topological molecule polar surface area 46.5

7. number of heavy atoms: 20

8. surface charge: 0

9. complexity: 335

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: 1

properties and stability

basic properties

white powder. soluble in acetone, insoluble in methanol, insoluble in water.

storage method

none yet

synthesis method

none yet

purpose

none yet