dibutoxyethyl phthalate

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:117-83-9

mdl number:mfcd00048781

einecs number:204-213-1

rtecs number:none

brn number:none

pubchem number:24869646

physical property data

1. characteristics: colorless liquid, slightly aromatic

2. density (g/ml,20℃） ：1.06

3. relative vapor density (g/ml, air =1): undetermined

4. melting point (ºc): undetermined

5. boiling point (ºc,normal pressure):220

6. boiling point (ºc, kpa): undetermined

7. refractive index:1.486

8. flashpoint (ºc):205

9. specific optical rotation (º): undetermined

10. autoignition point or ignition temperature (ºc): undetermined

11. vapor pressure (mmhg, ºc): undetermined

12. saturated vapor pressure (kpa, ºc): undetermined

13. heat of combustion (kj/mol): undetermined

14. critical temperature (ºc): undetermined

15. critical pressure (kpa): undetermined

16. oil and water (octanol/log value of the partition coefficient for water: undetermined

17. &orphan; tab-stops: list 36.0pt” align=left>1, molar refractive index:99.61

2, moore volume (m³/mol):343.0

3、 isotonic specific volume (90.2k) ：854.1

4, surface tension (dyne/cm):38.4

5、 polarizability (10^-24cm³):39.49

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: 6

4. number of rotatable chemical bonds: 16

5. number of tautomers: none

6. topological molecule polar surface area 71.1

7. number of heavy atoms: 26

8. surface charge: 0

9. complexity: 349

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

none

storage method

none

synthesis method

none

purpose

use synthesized from organic intermediates.

rial; mso-bidi-font-family: arial; mso-font-kerning: 0pt; mso-hansi-font-family: arial”>):38.4

5、 polarizability (10^-24cm³):39.49

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: 6

4. number of rotatable chemical bonds: 16

5. number of tautomers: none

6. topological molecule polar surface area 71.1

7. number of heavy atoms: 26

8. surface charge: 0

9. complexity: 349

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

none

storage method

none

synthesis method

none

purpose

use synthesized from organic intermediates.