Butyl ricinoleate
Structural formula
| Business number | 03YN |
|---|---|
| Molecular formula | C22H42O3 |
| Molecular weight | 354.57 |
| label |
[R-(Z)]-12-Hydroxy-9-octadecenoic acid butyl ester, N-Butyl 12-Hydroxyoleate, n-Butyl 12-hydroxy-9-octadecenoate |
Numbering system
CAS number:151-13-3
MDL number:None
EINECS number:205-785-5
RTECS number:None
BRN number:None
PubChem ID:None
Physical property data
1. Physical property data:
1. Boiling point (ºC,Normal pressure): 185ºC
2. Flash point (ºC): 115
3. Density (g/mL,55℃): 0.919
4. Melting point (ºC): -10 ºC
Toxicological data
None
Ecological data
3. Ecological data:
Usually for Water is not hazardous and materials should not be discharged into the surrounding environment without government permission.
Molecular structure data
5. Molecular property data:
1. Molar refractive index:107.29
2. Molar volume (m3/ mol):386.6
3. Isotonic specific volume (90.2K): 933.4
4. Surface tension (dyne/cm): 33.9
5. Polarizability（10-24cm3):42.53
Compute chemical data
4. Calculated chemical data:
1. Hydrophobic parameters Calculate reference value (XlogP）：7.3
2. Hydrogen Bonding Number of donors: 1
3. Hydrogen Bonding Number of receptors: 3
4. Rotatable Number of chemical bonds: 19
5. Topological molecule polar surface area (TPSA): 46.5
6. Heavy atoms Quantity: 25
7. Surface charge ：0
8. Complexity ：312
9. Isotope atomic number:0
10. Determine the number of atomic stereocenters:1
11. Uncertain number of atomic stereocenters:0
12. Determine the number of stereocenters of chemical bonds:1
13. Uncertain number of chemical bond stereocenters:0
14. Number of covalent bond units: 1
Properties and stability
Stable under normal temperature and pressure.
Storage method
Seal and store in a dry and cool place.
Synthesis method
None
Purpose
None
family: Arial; mso-hansi-font-family: Arial; mso-bidi-font-family: Arial”>Uncertain number of atomic stereocenters:0
12. Determine the number of stereocenters of chemical bonds:1
13. Uncertain number of chemical bond stereocenters:0
14. Number of covalent bond units: 1
Properties and stability
Stable under normal temperature and pressure.
Storage method
Seal and store in a dry and cool place.
Synthesis method
None
Purpose
None