8-quinolinecarboxylic acid

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:86-59-9

mdl number:mfcd00047619

einecs number:000-000-0

rtecs number:none

brn number:19176

pubchem number:24862841

physical property data

1. characteristics: undetermined.

2. density (g/ml,25/4℃): undetermined

3. relative vapor density (g/ml,air=1): undetermined

4. melting point (ºc): 183-185 °c

5. boiling point (ºc,normal pressure): undetermined

6. boiling point (ºc,5.2kpa): undetermined

7. refractive index: undetermined

8. flashpoint (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 (<span lang=en-us style="font-size: 9pt; font-family: arial; mso- font-kerninexplosion limit (%, v/v): undetermined

18. lower explosion limit (%,v/v): undetermined

19. solubility: insoluble in water.

toxicological data

none yet

ecological data

none yet

molecular structure data

5. molecular property data:

1. molar refractive index: 49.11

2. molar volume (m³/mol）：129.3

3. isotonic specific volume (90.2k):367.3

4. surface tension (dyne/cm):65.1

5. polarizability（10^-24cm³):19.47

compute chemical data

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

2. number of hydrogen bond donors: 1

3. number of hydrogen bond acceptors: 3

4. number of rotatable chemical bonds: 1

5. number of tautomers: none

6. topological molecule polar surface area 50.2

7. number of heavy atoms: 13

8. surface charge: 0

9. complexity: 205

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

none yet

storage method

this product should be stored in a sealed, cool, dry place.

synthesis method

none yet

purpose

for organic synthesis.

n-top-alt: auto; mso-margin-bottom-alt: auto; mso-list: l0 level2 lfo1; tab-stops: list 36.0pt” align=left>3. isotonic specific volume (90.2k): 367.3

4. surface tension (dyne/cm):65.1

5. polarizability（10^-24cm³):19.47

compute chemical data

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

2. number of hydrogen bond donors: 1

3. number of hydrogen bond acceptors: 3

4. number of rotatable chemical bonds: 1

5. number of tautomers: none

6. topological molecule polar surface area 50.2

7. number of heavy atoms: 13

8. surface charge: 0

9. complexity: 205

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

none yet

storage method

this product should be stored in a sealed, cool, dry place.

synthesis method

none yet

purpose

for organic synthesis.