3-hydroxy-2-methylbenzoic 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:603-80-5

mdl number:mfcd00671541

einecs number:000-000-0

rtecs number:none

brn number:2613791

pubchem id:none

physical property data

1. physical property data

3、 melting point: 143-148℃ .

toxicological data

none

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:39.88

2, molar volume (m³/mol):116.6

3, isotonic specific volume (90.2k ):322.0

4, surface tension (dyne/ cm):58.0

5、 polarizability (10^-24cm³):15.81

compute chemical data

1. reference value for hydrophobic parameter calculation (xlogp): 1.5

2. number of hydrogen bond donors: 2

3. number of hydrogen bond acceptors: 3

4. number of rotatable chemical bonds: 1

5. number of tautomers: 3

6. topological molecule polar surface area 57.5

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

properties and stability:

no decomposition products may occur under normal temperatures and pressures.

storage method

storage:

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

synthesis method

none

purpose

none