Triethyl orthopropionate
Structural formula
| Business number | 0387 |
|---|---|
| Molecular formula | C9H20O3 |
| Molecular weight | 176.26 |
| label |
CH3CH2C(OC2H5)3, Sensitizer |
Numbering system
CAS number:115-80-0
MDL number:MFCD00009226
EINECS number:204-108-0
RTECS number:None
BRN number:906798
PubChem number:24900343
Physical property data
1. Characteristics: Colorless transparent liquid , has an aromatic odor.
2. Density (g/mL,25℃): 0.88
3. Relative vapor density (g/mL,air=1): Undetermined
4. Melting point (ºC): Undetermined
5. Boiling point (ºC,normal pressure):155-160
6. Boiling point (ºC,KPa): Undetermined
7. Refractive index:1.402
8. Flashpoint (ºC): 60
9. Specific rotation (º): Undetermined
10. Autoignition point or ignition temperature (ºC): Undetermined
11. Vapor pressure (mmHg,ºC): 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/Log value of the partition coefficient for water: undetermined
17. Explosion upper limit (
2、 Moore Volume (m3/mol):196.2
3、 Isotonic specific volume (90.2K) ：444.3
4、 Surface Tension (dyne/cm):26.2
5、 Polarizability (10-24cm3):19.40
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: 3
4. Number of rotatable chemical bonds: 7
5. Number of tautomers: none
6. Topological molecule polar surface area 27.7
7. Number of heavy atoms: 12
8. Surface charge: 0
9. Complexity: 86.9
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
Does not decompose under normal temperature and pressure, avoid contact with Strong oxidants, strong acids, strong basesContact.
Storage method
None
Synthesis method
None
Purpose
Used as analytical reagents and film sensitizer , And used in organic synthesis, dye and pharmaceutical industries.
#304e00; FONT-FAMILY: 宋体; mso-fareast-font-family: Arial; mso-font-kerning: 0pt; mso-bidi-font-family: 宋体”> Polarizability (10-24cm3):19.40
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: 3
4. Number of rotatable chemical bonds: 7
5. Number of tautomers: none
6. Topological molecule polar surface area 27.7
7. Number of heavy atoms: 12
8. Surface charge: 0
9. Complexity: 86.9
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
Does not decompose under normal temperature and pressure, avoid contact with Strong oxidants, strong acids, strong basesContact.
Storage method
None
Synthesis method
None
Purpose
Used as analytical reagents and film sensitizer , And used in organic synthesis, dye and pharmaceutical industries.
