Nalpha-Fmoc-Ndelta-trityl-L-glutamine CAS132327-80-1

Details:

Density 1.3± 0.1g /cm3
Boiling point 873.5±65.0 °C at 760 mmHg
Melting point 165-172 °C
Molecular formula C39H34N2O5
Molecular weight 610.698
Flash point 482.1±34.3 °C
Accurate mass 610.246765
PSA 104.73000
LogP 8.09
Appearance properties white to off-white powder
Vapor pressure 0.0±0.3 mmHg at 25°C
Refractive index 1.636
Storage condition
Seal and store at 2 º C-8 ºC

stability
Avoid strong oxidants

Molecular structure
1. Molar refractive index: 174.29

2, molar volume (cm3/mol) : 485.9

3. Isotropic volume (90.2K) : 1326.9

4. Surface tension (dyne/cm) : 55.6

5. Dielectric constant: unavailable

6. Polarization (10-24cm3) : 69.09

7. Single isotope mass: 610.246772 Da

8. Nominal quality: 610 Da

9. Average quality: 610.6977 Da

Computational chemistry
1. Reference value of hydrophobic parameter calculation (XlogP) :7

2. Number of hydrogen bond donors :3

3. Number of hydrogen bond receptors :5

4. Number of rotatable bonds :12

5. Number of tautomers :4

6. Topological molecular polar surface area 105

7. Number of heavy atoms :46

8. Surface charge :0

9. Complexity :946

10. Number of isotope atoms :0

11. Determine the number of atomic constitutive centers :1

12. Number of indeterminate atomic orthotropic centers :0

13. Determine the number of chemical bond constitutive centers :0

14. Number of uncertain bond constitutive centers :0

15. Number of covalent bond units :1

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