bis(2-butoxyethyl) adipate
structural formula
| business number | 03ts |
|---|---|
| molecular formula | c18h34o6 |
| molecular weight | 346.46 |
| label |
dibutoxyethyl adipate, adipic acid bis(2-butyoxyethyl) ester, adipic acid di(2-butoxyethyl) ester, aliphatic compounds |
numbering system
cas number:141-18-4
mdl number:mfcd00053796
einecs number:205-466-0
rtecs number:au8450000
brn number:none
pubchem number:24869667
physical property data
1. physical property data
1. character: liquid
2. density (g/ml,25/4℃) ：0.997
3. boiling point (ºc,normal pressure):208 ºc
4. flash point (ºc):187.7 ºc
5. saturated vapor pressure (kpa,60ºc):<0.023
6. -font-family: arial”> solubility:slightly soluble in water and soluble in most organic solvents.
toxicological data
2. toxicological data:
1, acute toxicity: rat abdominal cavity ld50: 600 mg /kg
ecological data
3. ecology data:
1. other harmful effects: this substance may be harmful to the environment, and special treatment should be given to water bodies. notice.
molecular structure data
5. molecular property data:
1. molar refractive index:92.48
2. molar volume (cm3/mol): 345.3
3. isotonic specific volume (90.2k ):837.0
4.
1, acute toxicity: rat abdominal cavity ld50: 600 mg /kg
ecological data
3. ecology data:
1. other harmful effects: this substance may be harmful to the environment, and special treatment should be given to water bodies. notice.
molecular structure data
5. molecular property data:
1. molar refractive index:92.48
2. molar volume (cm3/mol): 345.3
3. isotonic specific volume (90.2k ):837.0
4. surface tension (dyne/ cm):34.5
5. polarizability（10-24cm3):36.66
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): 2.8
2. number of hydrogen bond donors: 0
3. number of hydrogen bond acceptors: 6
4. number of rotatable chemical bonds: 19
5. number of tautomers: none
6. topological molecule polar surface area 71.1
7. number of heavy atoms: 24
8. surface charge: 0
9. complexity: 276
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
stable under normal temperature and pressure.
incompatible materials:strong oxidizing agent
storage method
store in a cool, ventilated warehouse.
synthesis method
none yet
purpose
<font face=" it is an important chemical intermediate and used as a plasticizer.
; mso-ascii-font-family: arial; mso-hansi-font-family: arial; mso-bidi-font-family: arial”>surface tension (dyne/cm):34.5
5. polarizability（10-24cm3):36.66
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): 2.8
2. number of hydrogen bond donors: 0
3. number of hydrogen bond acceptors: 6
4. number of rotatable chemical bonds: 19
5. number of tautomers: none
6. topological molecule polar surface area 71.1
7. number of heavy atoms: 24
8. surface charge: 0
9. complexity: 276
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
stable under normal temperature and pressure.
incompatible materials:strong oxidizing agent
storage method
store in a cool, ventilated warehouse.
synthesis method
none yet
purpose
<font face=" it is an important chemical intermediate and used as a plasticizer.
