
structural formula
| business number | 078u |
|---|---|
| molecular formula | c4hf6no3 |
| molecular weight | 225.05 |
| label |
n,o-bis(trifluoroacetyl)hydroxylamine, aliphatic compounds |
numbering system
cas number:684-78-6
mdl number:mfcd00013565
einecs number:211-677-9
rtecs number:none
brn number:none
pubchem id:none
physical property data
1. character:.
2. density (g/ml,25/4℃):
3.relative vapor density (g/ml,air=1): undetermined
4. melting point (ºc):
5. boiling point (ºc,normal pressure):
6. boiling point (ºc,5.2kpa): undetermined
7. refractive index: undetermined
8. flashpoint (ºc): undetermined
9. specific optical rotation (º): undetermined
10. autoignition point or ignition temperature (ºc): undetermined
11. vapor pressure (kpa,25ºc): undetermined
12. saturated vapor pressure (kpa,60ºc): undetermined
13. heat of combustion ( kj/mol): undetermined
14. critical temperature (ºc): undetermined
15. critical pressure (kpa): undetermined
16. oil and water (octanol/logarial value of the partition coefficient of water: undetermined
17. explosion limit (%,v/v): undetermined
18. lower explosion limit (%,v/v): undetermined
19. solubility:.
toxicological data
none
ecological data
none
molecular structure data
1. molar refractive index: 26.89
2. molar volume(m3/ mol):136.7
3. isotonic ratio(90.2k):296.2
4. surface tension(dyne/cm):22.0
5. dielectric constant:
6. dipole moment(10 -24cm3):
7. polarizability: 10.66
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): 1.9
2. number of hydrogen bond donors: 1
3. number of hydrogen bond acceptors: 9
4. number of rotatable chemical bonds: 2
5. number of tautomers: 2
6. topological molecule polar surface area 55.4
7. number of heavy atoms: 14
8. surface charge: 0
9. complexity: 242
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. covalent bond�quantity: 1
properties and stability
none
storage method
none
synthesis method
none
purpose
none

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