trans-4-tert-Butylcyclohexanecarboxylic acid cas943-29-3

Details:

Density 1.0 ± 0.1 g/cm3
Boiling point 282.9 ± 8.0 ° C at 760 mmHg
Melting point 170-175 º C
Molecular formula C11H20O2
Molecular weight 184.275
Flash point 136.7 ± 13.1 ° C
Accurate quality 184.146332
PSA 37.30000
LogP 3.49
Appearance: White fine crystalline powder
Steam pressure 0.0 ± 1.2 mmHg at 25 ° C
Refractive index 1.474
Storage conditions
Keep the container sealed and store in a cool, dry place
Stability
Stable at room temperature and pressure, avoiding contact with oxides
Molecular structure
1. Molar refractive index: 51.97
2. Molar volume (m3/mol): 184.9
3. Isometric volume (90.2K): 455.4
4. Surface tension (dyne/cm): 36.7
5. Polarization rate (10-24cm3): 20.60
Computational chemistry
1. Reference value for hydrophobic parameter calculation (XlogP): 3.3
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond receptors: 2
4. Number of rotatable Chemical bond: 2
5. Topological molecule Polar surface area (TPSA): 37.3
6. Number of heavy atoms: 13
7. Surface charge: 0
8. Complexity: 183
9. Number of Isotope Atoms: 0
10. Determine the number of atomic structure centers: 0
11. Number of uncertain atomic construction centers: 0
12. Determine the number of chemical bond stereo centers: 0
13. Number of uncertain Chemical bond stereocenters: 0
14. Number of Covalent bond units: 1

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