Phloretin CAS60-82-2

Details:

Density 1.4± 0.1g /cm3
Boiling point 534.4±29.0 °C at 760 mmHg
Melting point ~260 °C
Molecular formula C15H14O5
Molecular weight 274.269
Flash point 291.1±20.8 °C
Accurate mass 274.084137
PSA 97.99000
LogP 3.50
Appearance properties crystalline solid
Vapor pressure 0.0±1.5 mmHg at 25°C
Refractive index 1.685
Storage condition
The product should be sealed with argon gas and kept dry at 4℃.

Water soluble soluble
Molecular structure
V. Molecular Property Data:

1. Molar refractive index: 72.92

2, molar volume (m3/mol) : 191.8

3. Isocapacious volume (90.2K) : 564.4

4. Surface tension (dyne/cm) : 74.8

5. Polarization (10-24cm 3) : 28.91

Computational chemistry
1. Reference value for calculating drainage parameters (XlogP) :2.6

2. Number of hydrogen bond donors :4

3. Number of hydrogen bond receptors :5

4. Number of rotatable bonds :4

5. Number of tautomers :50

6. Topological molecular polar surface area 98

7. Number of heavy atoms :20

8. Surface charge :0

9. Complexity :312

10. Number of isotope atoms :0

11. Determine the number of primary constitutive centers :0

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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