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.