n-methylimidazole

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:616-47-7

mdl number:mfcd00005292

einecs number:210-484-7

rtecs number:ni7000000

brn number:105197

pubchem number:24885291

physical property data

physical property data;
1. character:liquid

2. relative density:1.030

3. refractive index:1.4970

4. flashpoint (℃):92

5. melting point (℃):-60

6. boiling point (ºc):198

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:25.25

2, molar volume (m³/mol):82.3

3, isotonic specific volume (90.2k ):200.3

4, surface tension (dyne/ cm):34.9

5、 polarizability (10^-24cm³): 10.01

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: 1

4. number of rotatable chemical bonds: 0

5. number of tautomers: none

6. topological molecule polar surface area 17.8

7. number of heavy atoms: 6

8. surface charge: 0

9. complexity: 44.8

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. basic properties

liquid. hygroscopic. miscible with water. relative density 1.030. melting point-60℃. boiling point 198℃. refractive index 1.4970. flash point92℃. ld50 (mouse, oral) 1400mg/kg. corrosive.

storage method

2. storage

seal with nitrogen and store in a cool, dry place.

synthesis method

none

purpose

3. purpose

deoxyribose for nucleic acid synthesis. glycoacetylation catalyst.

resource:allhdi.com