1,4-cyclohexanedione bis(ethylene acetal)
Structural formula
| Business number | 0404 |
|---|---|
| Molecular formula | C10H16O4 |
| Molecular weight | 200.23 |
| label |
None yet |
Numbering system
CAS number:183-97-1
MDL number:MFCD00010851
EINECS number:None
RTECS number:None
BRN number:None
PubChem number:24857997
Physical property data
1. Melting point (ºC):79-80 °C(lit.)
2. Boiling point (ºC,Normal pressure):75-85 °C0.5 mm Hg(lit.)
3. Flashpoint (ºC):75-85°C/0.5mm
Toxicological data
None yet
Ecological data
None yet
Molecular structure data
1. Moore refraction Rate: 49.20
2. Molar Volume （cm3/mol）：163.6
3. isotonic ratio （90.2K )：415.9
4. Surface Tension（dyne/cm）: 41.7
5. Dielectric Constants: None available
6. Dipole Distance（10 -24cm3)：Not available
7, Polarization Rate: 19.50
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): 0.3
2. Number of hydrogen bond donors: 0
3. Number of hydrogen bond acceptors: 4
4. Number of rotatable chemical bonds: 0
5. Number of tautomers: none
6. Topological molecule polar surface area 36.9
7. Number of heavy atoms: 14
8. Surface charge: 0
9. Complexity: 180
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 yet
Storage method
None yet
Synthesis method
None yet
Purpose
None yet
