dimethyl itaconate

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:617-52-7

mdl number:mfcd00008446

einecs number:210-519-6

rtecs number:none

brn number:386674

pubchem number:24881766

physical property data

1. physical property data

1. melting point (ºc): 38ºc

2. boiling point (ºc, normal pressure): 208 °c0.1 mm hg (lit.)

3. density: 1.124 g/ml at 25 °c(lit.

4. flash point (ºc): 213 °f

5. normal temperature refractive index (n²⁰): 1.4457

6. relative density (20℃, 4℃): 1.1241¹⁸

toxicological data

none yet

ecological data

3. ecological data:

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

molecular structure data

5. molecular property data:

1. molar refractive index: 37.59

2. molar volume (cm³/mol): 145.9

3. isotonic specific volume (90.2k): 345.2

4. surface tension (dyne/cm): 31.3

5. polarizability (10^-24cm³): 14.90

compute chemical data

1. reference value for hydrophobic parameter calculation (xlogp): 0.5

2. number of hydrogen bond donors: 0

3. number of hydrogen bond acceptors: 4

4. number of rotatable chemical bonds: 5

5. number of tautomers: none

6. topological molecule polar surface area 52.6

7. number of heavy atoms: 11

8. surface charge: 0

9. complexity: 183

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:

the product may not decompose under normal temperature and pressure.

storage method

storage:

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

synthesis method

none yet

purpose

uses:

used as lubricating oil thickener, copolymer latex, descaling agent for water treatment, surfactant, modified alkyd resin, etc.

resource:allhdi.com