Phloretin Phloretin

Structural formula

Business number	01BN
Molecular formula	C15H14O5
Molecular weight	274.28
label	β-(4-Hydroxyphenyl)-2,4,6-trihydroxypropiophenone, 3-(4-Hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)-1-propanone, 2′,4′,6′-Trihydroxy-3-(4-hydroxyphenyl)propiophenone

• Numbering system
• Physical property data
• Toxicological data
• Ecological data
• Molecular structure data
• Computing chemical data
• More
  • Properties and Stability
  • Storage method
  • Synthesis method
  • Purpose

Numbering system

CAS number:60-82-2

MDL number:MFCD00002288

EINECS number:200-488-7

RTECS number:None

BRN number:1887240

PubChem number:24278652

Physical property data

1. SexShape: needle-like crystal. Hygroscopic.

2. Density (g/mL,25/4℃): Undetermined

3. Relative vapor density ( g/mL,Air=1): Undetermined

4. Melting point (ºC): 262℃ decomposition

5. Boiling point (ºC,Normal pressure): Undetermined

6. Boiling point (ºC,5.2kPa): Undetermined

7. Refractive index: Undetermined

8. Flashpoint (ºC): Undetermined

9. Specific optical rotation (º): Undetermined

10. Autoignition point or ignition temperature (ºC): Undetermined

11. Vapor pressure (kPa,25ºC): Undetermined

12. Saturation vapor pressure (kPa,60ºC): Undetermined

13. Heat of combustion (KJ/mol): Undetermined

14. Critical temperature (5. Molecular property data:

1. Molar refractive index: 72.92

2. Molar volume (m³/mol）：191.8

3. isotonic specific volume (90.2K):564.4

4. Surface Tension (dyne/cm):74.8

5. Polarizability（10^-24cm³): 28.91

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): 2.6

2. Number of hydrogen bond donors: 4

3. Number of hydrogen bond acceptors: 5

4. Number of rotatable chemical bonds: 4

5. Number of tautomers: 50

6. Topological molecule 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 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 yet

Storage method

This product should be sealed with argon gas4Store dry at ℃.

Synthesis method

None yet

Purpose

For biochemical research.

. Number of rotatable chemical bonds: 4

5. Number of tautomers: 50

6. Topological molecule polar surface area 98

7. Heavy atoms Number: 20

8. Surface charge: 0

9. Complexity: 312

10. Number of isotope atoms: 0

11. Determine the number of stereocenters of atoms: 0

12. Determine the number of stereocenters of atoms: 0

13. Determine the number of stereocenters of chemical bonds: 0

14. Number of uncertain chemical bond stereocenters: 0

15. Number of covalent bond units: 1

Properties and stability

None yet

Storage method

This product should be sealed with argon gas4Store dry at ℃.

Synthesis method

None yet

Purpose

For biochemical research.