2,2,3,3,3-pentafluoro-1-propanol
structural formula
| business number | 04ry |
|---|---|
| molecular formula | c3h3of5 |
| molecular weight | 150.05 |
| label |
pentafluoropropanol, 1h,1h-pentafluoropropanol, 2,2,3,3,3-pentafluoro-1-propanol, 2,2,3,3,3-pentafluoro-1-propanol, 95+%, pfpoh, pentafluoropropanol, perfluorodihydropropanol, pentafluoro-1-propanol, 1,1-dihydroperfluoropropanol, 1,1h-perfluoropropanol, 1-propanol, 2,2,3,3,3-pentafluoro-, 2,2,3,3,3-pentafluoro-1-propano |
numbering system
cas number:422-05-9
mdl number:mfcd00004673
einecs number:207-012-7
rtecs number:ub8800000
brn number:1743133
pubchem number:24855590
physical property data
1. physical property data
properties: colorless liquid
density (g/ml, 25/4 ℃): 1.505
relative density (20℃, 4℃): 1.505
melting point (ºc): -15
boiling point (ºc, normal pressure): 80
refractive index at normal temperature (n25): 1.2882
refractive index: 1.288
flash point (ºc): not available
specific rotation (º): not available
autoignition point or ignition temperature (ºc): not available
vapor pressure (kpa, 25ºc): not available
p>
saturated vapor pressure (kpa, 60ºc): not available
heat of combustion (kj/mol): not available
critical temperature (ºc): not available
critical pressure (kpa): not available
oil-water (octanol/ log value of the partition coefficient (water): not available
upper explosion limit (%, v/v): not available
lower explosion limit (% ,v/v): not available
solubility: soluble in water
toxicological data
2. toxicological data:
acute toxicity: ld50: 1000 mg/kg (orally in mice) lc50: 10000 mg/m3 (mouse inhalation).
ecological data
3. ecological data:
1. other harmful effects: this substance may be harmful to the environment, and special attention should be paid to water bodies.
molecular structure data
1. molar refractive index: 18.23
2. molar volume (cm3/mol): 102.8
3. isotonic specific volume (90.2k ): 205.9
4. surface tension (dyne/cm): 16.0
5, polarizability (10-24cm3): 7.22
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): none
2. number of hydrogen bond donors: 1
3. number of hydrogen bond acceptors: 6
4. number of rotatable chemical bonds: 1
5. number of tautomers: none
6. topological molecule polar surface area 20.2
7. number of heavy atoms: 9
8. surface charge: 0
9. complexity: 94.9
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