2-methyl-3-nitroaniline

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:603-83-8

mdl number:mfcd00007731

einecs number:210-059-6

rtecs number:xu8200000

brn number:388393

pubchem number:24869601

physical property data

1. physical property data

boiling point: 305℃
melting point: 87-91℃

water solubility:<0.1 g/100 ml at 23°c

toxicologydata

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:41.85

2, molar volume (m³/mol):119.8

3, isotonic specific volume (90.2k): 326.2

4, surface tension (dyne/cm):54.9

5, polarizability (10^-24cm³ ):16.59

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: 0

5. number of tautomers: none

6. topological molecule polar surface area 71.8

7. number of heavy atoms: 11

8. surface charge: 0

9. complexity: 155

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: water-soluble<0.1 g/100 ml at 23° c

storage method

storage:

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

synthesis method

none yet

purpose

none yet