tripropionin
Structural formula
| Business number | 03SD |
|---|---|
| Molecular formula | C12H20O6 |
| Molecular weight | 260.28 |
| label |
Glyceryl tripropionate, food additives, Flavor enhancer |
Numbering system
CAS number:139-45-7
MDL number:MFCD00027005
EINECS number:205-365-1
RTECS number:YK6000000
BRN number:None
PubChem number:24901610
Physical property data
None
Toxicological data
Acute toxicity data :
Rat Sutra Mouth LD50: 6400mg/kg
Rat inhalation LC：>220ppm/6H
Mouse Sutra Mouth LD50: 6400mg/kg
Mouse vein LD50：840mg/kg
Ecological data
None
Molecular structure data
Molecular property data: 1、 Molar refractive index：62.92 2, Molar volume（m3/mol) ：237.4 3, Isotonic specific volume（90.2K）：581.1 4, Surface tension（3.0 dyne/cm):35.8 5, Polarizability（0.5 10-24 cm3):24.94
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: 6
4. Number of rotatable chemical bonds: 11
5. Number of tautomers: none
6. Topological molecule polar surface area 78.9
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. 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
Before shipping Check whether the packaging container is complete and sealed, and ensure that the container does not leak, collapse, fall, or be damaged during transportation. It is strictly prohibited to mix and transport it with oxidants, etc. When shipping, it should be isolated from the engine room, power supply, fire source and other parts. When transporting by road, follow the prescribed route.
Synthesis method
None
Purpose
Organic reagents, medicine Intermediates
-HEIGHT: 13.5pt; TEXT-ALIGN: left; mso-margin-top-alt: auto; mso-margin-bottom-alt: auto; mso-pagination: widow-orphan; tab-stops: list 36.0pt” align= left>5, Polarizability（0.5 10-24cm3):24.94
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: 6
4. Number of rotatable chemical bonds: 11
5. Number of tautomers: none
6. Topological molecule polar surface area 78.9
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. 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
Before shipping Check whether the packaging container is complete and sealed, and ensure that the container does not leak, collapse, fall, or be damaged during transportation. It is strictly prohibited to mix and transport it with oxidants, etc. When shipping, it should be isolated from the engine room, power supply, fire source and other parts. When transporting by road, follow the prescribed route.
Synthesis method
None
Purpose
Organic reagents, medicine Intermediates
