5-methylisatin

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:608-05-9

mdl number:mfcd00005721

einecs number:210-152-1

rtecs number:nl7939300

brn number:123738

pubchem number:24896609

physical property data

1. characteristics: purple-red crystal

2. melting point:184-188℃

toxicological data

none yet

ecological data

3. ecological data:

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

molecular structure data

5. molecular property data:

1, molar refractive index:42.24

2, molar volume (m³/mol):123.8

3, isotonic specific volume (90.2k):329.3

4、 surface tension (dyne/cm):50.0

5, polarizability (10^-24cm³ ):16.74

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: 2

4. number of rotatable chemical bonds: 0

5. number of tautomers: 15

6. topological molecule polar surface area 46.2

7. number of heavy atoms: 12

8. surface charge: 0

9. complexity: 237

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: this product is purple-red crystal.

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

resource:allhdi.com