5-Chloro-2-hydroxybenzophenone 5-Chloro-2-hydroxybenzophenone
Structural formula
| Business number | 01VG |
|---|---|
| Molecular formula | C13H9ClO2 |
| Molecular weight | 232.66 |
| label |
2-Hydroxy-5-chlorobenzophenone, ClC6H3(OH)COC6H5 |
Numbering system
CAS number:85-19-8
MDL number:MFCD00020134
EINECS number:201-592-5
RTECS number:None
BRN number:None
PubChem number:24892696
Physical property data
1. Physical property data
1. Character: Uncertain.
2. Density (g/mL,25/4℃): Unsure
3. Relative vapor density (g/mL,AIR=1): Unsure
4. Melting point (ºC):96-98 °C
5. Boiling point (ºC,Normal pressure): Uncertain
6. Boiling point (ºC,5.2kPa): Unsure
7. Refractive index: Uncertain
8. Flash Point (ºC): Unsure
9. Specific optical rotation (º): Unsure
10. Autoignition point or ignition temperature (ºC): Unsure
11. Vapor pressure (kPa,25ºC): Unsure
17. Explosion limit (%,V/V): Unsure
18. Lower explosion limit (%,V/V): Unsure
19. Solubility: Uncertain.
Toxicological data
None yet
Ecological data
None yet
Molecular structure data
5. Molecular property data:
1. Molar refractive index: 62.82
2. Molar Volume (m3/mol）：177.9
3. isotonic specific volume (90.2K):477.7
4. Surface Tension (dyne/cm):51.9
5. Polarizability（10-24cm3):24.90
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond acceptors: 2
4. Number of rotatable chemical bonds: 2
5. Number of tautomers: 4
6. Topological molecule polar surface area 37.3
7. Number of heavy atoms: 16
8. Surface charge: 0
9. Complexity: 248
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
None yet
Synthesis method
None yet
Purpose
None yet
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3. isotonic specific volume (90.2K):477.7
4. Surface Tension (dyne/cm):51.9
5. Polarizability（10-24cm3):24.90
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond acceptors: 2
4. Number of rotatable chemical bonds: 2
5. Number of tautomers: 4
6. Topological molecule polar surface area 37.3
7. Number of heavy atoms: 16
8. Surface charge: 0
9. Complexity: 248
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
None yet
Synthesis method
None yet
Purpose
None yet
