N-boc-aniline name
Its Chinese name is N-Boc-aniline
The English name is tert-butyl N-phenylcarbamate
Chinese alias tert - butyl phenyl carbamate | tertiary butyl - N - phenyl carbamate
More English nicknames
Physicochemical properties of N-Boc-aniline
Density 1.1± 0.1g /cm3
Boiling point 235.3±9.0 °C at 760 mmHg
Melting point 133-137 °C(lit.)
Molecular formula C11H15NO2
Molecular weight 193.242
Flash point 96.1±18.7 °C
Accurate mass 193.110275
PSA 38.333000
LogP 3.00
Vapor pressure 0.1±0.5 mmHg at 25°C
Refractive index 1.542
Storage condition
Keep in a cool, dry place
stability
Stable at normal temperature and pressure
Molecular structure
1. Molar refractive index: 56.13
2. Molar volume (m3/mol) : 178.4
3. Isotropic volume (90.2K) : 445.1
4. Surface tension (dyne/cm) : 38.7
5. Dielectric constant (F/m) : unavailable
6. Dipole distance (D) : No use
7, polarization (10-24cm 3) : 22.25
Computational chemistry
1. Reference value of hydrophobic parameter calculation (XlogP) : 2.7
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond receptors: 2
4. Number of rotatable bonds: 3
5. Number of tautomers: 2
6. Topological molecular polar surface area (TPSA) : 38.3
7. Number of heavy atoms: 14
8. Surface charge: 0
9. Complexity: 190
10. Number of isotope atoms: 0
11. Determine the number of atomic constitutive centers: 0
12. Number of uncertain atomic constitutive centers: 0
13. Determine the number of chemical bond structure centers: 0
14. Number of uncertain chemical bond structure centers: 0
15. Number of covalent bond units: 1
more
1. Character: not determined
2. Density (g/mLat 25°C) : Not determined
3. Relative vapor density (g/mL, air =1) : not determined
4. Melting point (ºC) : 133-137
5. Boiling point (ºC, atmospheric pressure) : not determined
6. Boiling point (ºC,754mmHg) : Not determined
7. Refractive index (n20/D) : not determined
8. Flash point (ºC) : Not determined
9. Specific rotation (º) : Not determined
10. Spontaneous ignition point or ignition temperature (ºC) : not determined
11. Vapor pressure (mmHg,37ºC) : Not determined
12. Saturated vapor pressure (kPa,114.4 ºC) : Not determined
13. Heat of combustion (KJ/mol) : not determined
14. Critical temperature (ºC) : Not determined
15. Critical pressure (MPa) : Not determined
16. Logarithmic value of oil-water (octanol/water) partition coefficient: not determined
17. Upper explosion limit (%,V/V) : Not determined
18. Lower explosive Limit (%,V/V) : Not determined
19. Solubility: not determined
China
