structural formula
business number | 024s |
---|---|
molecular formula | c12h22 |
molecular weight | 166.30 |
label |
dicyclohexyl, cyclohexylcyclohexane |
numbering system
cas number:92-51-3
mdl number:mfcd00003815
einecs number:202-161-4
rtecs number:none
brn number:1848266
pubchem id:none
physical property data
1. properties: colorless flowing liquid. has a pleasant smell. stable to oxidizing agents.
2. density (g/ml, 25/4℃): 0.880
3. relative vapor density (g/ml, air=1): undetermined
4. melting point (ºc): 3~4
5. boiling point (ºc, normal pressure): 238.5
6. boiling point (ºc, 5.2kpa): undetermined
7. refractive index (n20d): 1.479
8. flash point (ºc): 92
9. specific 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/ log value of the distribution coefficient (water): undetermined
17. explosion upper limit (%, v/v): undetermined
18. explosion lower limit (%, v/v): undetermined
19. solubility: easily soluble in acetone, ether, ethanol and benzene, insoluble in water.
toxicological data
ecological data
none
molecular structure data
1. molar refractive index: 53.38
2. molar volume (cm3/mol): 186.5
3. isotonic specific volume (90.2k ): 446.6
4. surface tension (dyne/cm): 32.8
5. dielectric constant (f/m): 2.23
6. pole chemical rate (10-24cm3): 21.16
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): 5.7
2. number of hydrogen bond donors: 0
3. number of hydrogen bond acceptors: 0
4. number of rotatable chemical bonds: 1
5. number of tautomers: none
6. topological molecule polar surface area 0
7. number of heavy atoms: 12
8. surface charge: 0
9. complexity: 100
10. number of isotope atoms: 0
11. determine the number of atomic stereocentersamount: 0
12. uncertain number of stereocenters of atoms: 0
13. determined number of stereocenters of chemical bonds: 0
14. uncertain chemical bonds number of stereocenters: 0
15. number of covalent bond units: 1
properties and stability
1. exist in flue-cured tobacco smoke.
storage method
this product should be kept sealed.
synthesis method
1. tobacco: fc, 18.
purpose
high boiling point solvent. penetrant.
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