5-nitroquinoline

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:607-34-1

mdl number:mfcd00006790

einecs number:210-134-3

rtecs number:vc1850000

brn number:none

pubchem number:24897569

physical property data

physical property data;
1. character: colorless needle crystal

2. melting point73-75℃(71 ℃)

3. solubility: soluble in hot ethanol and benzene, slightly soluble in hot water

toxicological data

none yet

ecological data

3. ecological data:

1. other harmful effects: this substance may be harmful to the environment and should be harmful to water bodies. give special attention.

molecular structure data

5. molecular property data:

1、 molar refractive index:48.73

2、 molar volume (m³/mol):128.6

3, isotonic specific volume (90.2k ):360.7

4、 surface tension (dyne/cm):61.8

5, polarizability (10^-24cm³ ):19.31

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: 3

4. number of rotatable chemical bonds: 0

5. number of tautomers: none

6. topological molecule polar surface area 58.7

7. number of heavy atoms: 13

8. surface charge: 0

9. complexity: 202

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

1. properties: colorless needle crystal.

storage method

storage:

seal the secret container and store it in a sealed main container in a cool place dry position.

synthesis method

2. preparation method: obtained from nitration of quinoline.

purpose

3. use: for organic synthesis.

resource:allhdi.com