
structural formula
| business number | 04jc |
|---|---|
| molecular formula | c5h4fn |
| molecular weight | 97.09 |
| label |
fc5h4n, heterocyclic compounds |
numbering system
cas number:372-47-4
mdl number:mfcd00006374
einecs number:206-755-4
rtecs number:none
brn number:105702
pubchem number:24851781
physical property data
一 , physical property data
traits :colorless transparent liquid
density (g/ml,25/4℃): 1.129
relative vapor density (g/ml, air=1):not available
melting point (ºc): not available
boiling point (ºc, normal pressure): 106-108
boiling point (ºc, 5.2kpa): not available
refractive index: 1.472
flash point (ºc): 13
optical rotation (º): not available
spontaneous combustion point or ignition temperature (ºc): not available
steam pressure (kpa, 25ºc): not available
saturated vapor pressure (kpa, 60ºc): not available
burn heat (kj/mol):not available
critical temperature (ºc): not available
critical pressure (kpa): not available
oil and water log value of the (octanol/water) partition coefficient:not available
explosion upper limit (%, v/v): not available
explosion lower limit (%, v/v): not available
dissolve properties: not available
toxicological data
two , toxicological data:
acute toxicity:not available .
ecological data
three , ecological data:
1 ,other harmful effects: this substance may be harmful to the environment, and special treatment should be given to water bodies. notice.
molecular structure data
1. molar refractive index:24.33
2. molar volume (m3/mol):86.8
3. isotonic specific volume (90.2k): 208.5
4. surface tension (dyne/cm): 33.2
5. polarizability(10-24cm3):9.64
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: 2
4. number of rotatable chemical bonds: 0
5. number of tautomers: none
6. topological molecule polar surface area 12.9
7. number of heavy atoms: 7
8. surface charge: 0
9. complexity: 56
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
storage method
none
synthesis method
none
purpose
used as pharmaceutical and pesticide intermediates

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