Diethylaminoethoxyethanol 2-(2-Diethylaminoethoxy)ethanol
Structural formula
| Business number | 03TC |
|---|---|
| Molecular formula | C8H19NO2 |
| Molecular weight | 161.24 |
| label |
2-(2-diethylaminoethoxy)ethanol, 2-(Beta-(diethylamino)ethoxy)ethanol, 6-Ethyl-3-oxa-6-azaoctanol, aliphatic compounds |
Numbering system
CAS number:140-82-9
MDL number:MFCD00020604
EINECS number:205-436-7
RTECS number:None
BRN number:None
PubChem ID:None
Physical property data
1. Physical property data:
1. Character: colorless liquid
2. Density (g/mL ,20/4℃）： 0.941
3. Refractive index (nD20):1.448
4. Boiling point (ºC,1.33kpa):100-104
5. Flash point (ºC): 96
Toxicological data
2. Toxicological data:
1, acute toxicity: rabbit oral LDLo: 2590 uL/kg;
Rabbit skinLD50：2020 uL/kg.
Ecological data
3. Ecological data:
Usually for Water is not hazardous and materials should not be discharged into the surrounding environment without government permission. SPAN>
Molecular structure data
5. Molecular property data: 1. Molar refractive index:46.11 2. Molar volume (m3/ mol):171.7 3. Isotonic specific volume (90.2K): 412.5 4. Surface tension (dyne/cm): 33.3 5. Polarizability（10-24cm3):18.28
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): 0.2
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond acceptors: 3
4. Number of rotatable chemical bonds: 7
5. Number of tautomers: none
6. Topological molecule polar surface area 32.7
7. Number of heavy atoms: 11
8. Surface charge: 0
9. Complexity: 74.5
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 0
12. Uncertain atomic stereocentersso-margin-bottom-alt: auto; mso-list: l0 level2 lfo1; tab-stops: list 36.0pt 72.75pt” align=left>1. Molar refractive index:46.11
2. Molar volume (m3/ mol):171.7
3. Isotonic specific volume (90.2K): 412.5
4. Surface tension (dyne/cm): 33.3
5. Polarizability（10-24cm3):18.28
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): 0.2
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond acceptors: 3
4. Number of rotatable chemical bonds: 7
5. Number of tautomers: none
6. Topological molecule polar surface area 32.7
7. Number of heavy atoms: 11
8. Surface charge: 0
9. Complexity: 74.5
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. SPAN>
Storage method
Save in a dry and cool place.
Synthesis method
Obtained from the etherification of diethylaminoethanol and ethylene oxide.
Purpose
Used in the production of antitussives such as Kebiqing.
Quantity: 0
13. Determined number of stereocenters of chemical bonds: 0
14. Uncertain number of stereocenters of chemical bonds: 0
15. Covalent bonds Number of units: 1
Properties and stability
Stable under normal temperature and pressure. SPAN>
Storage method
Save in a dry and cool place.
Synthesis method
Obtained from the etherification of diethylaminoethanol and ethylene oxide.
Purpose
Used in the production of antitussives such as Kebiqing.