2-(allyloxy)ethanol 2-(Allyloxy)ethanol
Structural formula
| Business number | 033K |
|---|---|
| Molecular formula | C5H10O2 |
| Molecular weight | 102.13 |
| label |
Monopropylene glycol, Ethylene glycol monopropenyl ether, 2-(2-propyleneoxy)ethanol, Ethylene glycol monoallyl ether, Allyl Hydroxyethyl Ether, Allyl glycol, 2-Allyloxyethanol, 2-(2-Propenyloxy)-ethano, Ethylene glycol allyl ether, linear compound |
Numbering system
CAS number:111-45-5
MDL number:MFCD00020607
EINECS number:203-871-7
RTECS number:KJ5425000
BRN number:None
PubChem number:24871224
Physical property data
1. Character: Undetermined
2. Density (g/mL,20℃):0.95
3. Relative vapor density (g/mL,Air =1): Undetermined
4. Melting point (ºC): Undetermined
5. Boiling point (ºC,normal pressure):159
6. Boiling point (ºC,kPa): Undetermined
7. Refractive index:1.436
8. Flashpoint (ºC):150
9. Specific optical rotation (º): Undetermined
10. Autoignition point or ignition temperature (ºC): Undetermined
11. Vapor pressure (mmHg,25ºC): 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/Water) partition coefficient0″ align=left>Mouse gastrointestinal administrationLDLO:2gm/kg
Ecological data
None
Molecular structure data
5. Molecular property data:
1. Molar refractive index: 31.53
2. Molar volume (m3/mol）：123.9
3. isotonic specific volume (90.2K):240.2
4. Surface Tension (dyne/cm):25.94
5. Polarizability（10-24cm3):12.50
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond acceptors: 2
4. Number of rotatable chemical bonds: 4
5. Number of tautomers: none
6. Topological molecule polar surface area 29.5
7. Number of heavy atoms: 7
8. Surface charge: 0
9. Complexity: 43.3
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
None
ont-family: ‘Times New Roman’; mso-hansi-font-family: ‘Times New Roman’; mso-bidi-font-family: Arial”>（10-24cm3）：12.50
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond acceptors: 2
4. Number of rotatable chemical bonds: 4
5. Number of tautomers: none
6. Topological molecule polar surface area 29.5
7. Number of heavy atoms: 7
8. Surface charge: 0
9. Complexity: 43.3
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
None
