Fluorocyclohexylamine
Structural formula
| Business number | 04JB |
|---|---|
| Molecular formula | C6H11F |
| Molecular weight | 102.15 |
| label |
aromatic fluoride |
Numbering system
CAS number:372-46-3
MDL number:MFCD00021285
EINECS number:206-754-9
RTECS number:None
BRN number:1900795
PubChem ID:None
Physical property data
1. Physical property data
Gas phase standard entropy (J·mol-1·K-1): 335.21
Density (g/mL, 25/4℃): 0.928
Relative density (20℃, 4℃) : 0.9278
Melting point (ºC): 13
Boiling point (ºC, normal pressure): 103
Gas phase standard hot melt (J·mol-1·K-1): 116.7
Refractive index at room temperature ( n20): 1.4146
Flash point (ºC): 5
Specific rotation (º): Not available
Autoignition point or ignition temperature (ºC): Not available
Vapor pressure (kPa, 25ºC): Not available
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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 distribution coefficient of water): Not available
Upper explosion limit (%, V/V): Not available
Lower explosion limit (% ,V/V): Not available
Solubility: Not available
Toxicological data
2. Toxicological data:
Acute toxicity: Not available.
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: 37.87
2. Molar volume (cm3/mol): 114.6
3. Isotonic specific volume (90.2K ): 247.7
4. Surface tension (dyne/cm): 21.8
5. Polarizability (10-24cm3): 11.05
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: 1
4. Number of rotatable chemical bonds: 0
5. Number of tautomers: none
6. Topological molecule polar surface area 0
7. Number of heavy atoms: 7
8. Surface charge: 0
9. Complexity: 46.1
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
Storage method
None
Synthesis method
None
Purpose
None
