Tri-n-butyl orthoformate
Structural formula
| Business number | 05ZE |
|---|---|
| Molecular formula | C13H28O3 |
| Molecular weight | 232.36 |
| label |
Tri-n-butyl orthoformate, Tributyl orthoformate, Tri-n-butyl orthoformate, 97%, ORTHOFORMIC ACID TRIBUTYL ESTER, ORTHOFORMIC ACID TRI-N-BUTYL ESTER, 1,1’,1’’-[methylidynetris(oxy)]tris-butan, TNBOF, TRIBUTOXYMETHANE, TRIBUTYL ORTHOFORMATE, TRI-N-BUTYL ORTHOFORMATE, BUTYL ORTHOFORMATE, Acetal/ketone/orthoester, organic oxides |
Numbering system
CAS number:588-43-2
MDL number:MFCD00015250
EINECS number:209-618-7
RTECS number:None
BRN number:1752526
PubChem number:24886841
Physical property data
1. Physical property data
1. Boiling point (ºC,Normal pressure): 122-124 °C(lit.)
2. Density:0.872g/mL at 25 °C(lit.
3. Refractive index:n20/D 1.418(lit.)
4. Flash Point (ºC):89
Toxicological data
None
Ecological data
3. Ecological data:
1, other harmful effects: This substance may be harmful to the environment, special attention should be paid to water bodies.
Molecular structure data
Molecular property data:
1, Molar refractive index:67.47
2, Molar volume (m3/mol):262.5
3, Isotonic specific volume (90.2K ):605.7
4, Surface tension (dyne/ cm):28.3
5、 Polarizability (10-24cm3): 26.74
Calculate chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): 3.8
2. Number of hydrogen bond donors: 0
3. Number of hydrogen bond acceptors: 3
4. Number of rotatable chemical bonds: 12
5. Number of tautomers: none
6. Topological molecule polar surface area 27.7
7. Number of heavy atoms: 16
8. Surface charge: 0
9. Complexity: 105
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
Stability and reactivity:
Materials to avoid: Oxides.
Products to be decomposed: carbon monoxide and carbon dioxide.
Storage method
Storage:
Seal the secret container and store it in a sealed main container in a cool place Dry position.
Synthesis method
None
Purpose
None