Isopropyl phthalate
Structural formula
| Business number | 068M |
|---|---|
| Molecular formula | C14H18O4 |
| Molecular weight | 250.29 |
| label |
1,2-Bis(1-methylethyl)phthalate, Diisopropyl phthalate, Diisopropyl phthalate, Diisopropyl phthalate |
Numbering system
CAS number:605-45-8
MDL number:MFCD00053717
EINECS number:210-086-3
RTECS number:TI1350000
BRN number:1972723
PubChem number:24887528
Physical property data
Physical property data:
1. Density (g/mL ,25/4℃):1.063
2. Refractive index (nD20):1.490
3. Freeze Point (℃):>18
4. Boiling point (ºC): 302
Toxicological data
None yet
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:68.24 2, Moore Volume (m3/mol):231.9 3, Isotonic specific volume (90.2K ):570.8 4, Surface tension (dyne/ cm):36.6 5、 Polarizability (10-24cm3): 27.05
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: 4
4. Number of rotatable chemical bonds: 6
5. Number of tautomers: none
6. Topological molecule polar surface area 52.6
7. Number of heavy atoms: 18
8. Surface charge: 0
9. Complexity: 266
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 0
12. Uncertain Number of atomic stereocenters: 0
13. Determined number of stereocenters of chemical bonds: 0
14. Uncertain number of stereocenters of chemical bonds: 0
15 .Number of covalent bond units: 1
Properties and stability
Properties and stability:
No decomposition products may occur under normal temperatures and pressures.
Storage method
1, storage
Package is complete, pack with care; the warehouse is ventilated, away from open flames, high temperatures, and stored separately from oxidants.
Synthesis method
None yet
Purpose
None yet
