tri-n-butylboron tri-n-butylboron
structural formula
| business number | 03f5 |
|---|---|
| molecular formula | c12h27b |
| molecular weight | 182.15 |
| label |
tributylboron, trin-butylboron, tributylboron, tri-n-butylboron, borane, tributyl-, borane,tributyl-, tributyl-boran, tributylborine, tri-n-butylborane, linear compound |
numbering system
cas number:122-56-5
mdl number:mfcd00009423
einecs number:204-554-6
rtecs number:ed1850000
brn number:none
pubchem number:24857985
physical property data
1. density (g/ml ,25/4℃）： 0.834
2. flash point (°f):1
3. melting point (℃):-34
4. boiling point (ºc,20 mmhg): 109
toxicological data
1, acute toxicity: rat oral ld50: 1125mg/kg
rat intravenously injected ld50: 104mg/kg
ecological data
none yet
molecular structure data
1. molar refractive index: 61.07
2. molar volume（m3/ mol）：248.5
3. isotonic ratio（90.2k）：546.5
4. surface tension（dyne/cm）：23.3
5. dielectric constant:
6. dipole moment（10 -24cm3)(m3/mol）：248.5
3. isotonic ratio（90.2k）：546.5
4. surface tension（dyne/cm）：23.3
5. dielectric constant:
6. dipole moment（10 -24cm3)：
7. polarizability: 24.21
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: 0
4. number of rotatable chemical bonds: 9
5. number of tautomers: none
6. topological molecule polar surface area 0
7. number of heavy atoms: 13
8. surface charge: 0
9. complexity: 72.1
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 yet
storage method
none yet
synthesis method
none yet
purpose
none yet
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7. polarizability: 24.21
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: 0
4. number of rotatable chemical bonds: 9
5. number of tautomers: none
6. topological molecule polar surface area 0
7. number of heavy atoms: 13
8. surface charge: 0
9. complexity: 72.1
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 yet
storage method
none yet
synthesis method
none yet
purpose
none yet
