2-methylbenzophenone
Structural formula
| Business number | 03N4 |
|---|---|
| Molecular formula | C14H12O |
| Molecular weight | 196.24 |
| label |
CH3C6H4COC6H5, 2-methylbenzophenone, 2-methylbenzophenone, (2-Methylphenyl)phenyl-methanon, aromatic compounds |
Numbering system
CAS number:131-58-8
MDL number:MFCD00008518
EINECS number:205-032-0
RTECS number:None
BRN number:None
PubChem number:24849684
Physical property data
1. Character: colorless or light yellow transparent liquid
2. Density (g/mL ,25/4℃）： 1.083
3. Refractive index (nD20):1.593-1.595
4. Melting point (℃):-18
5. Boiling point (ºC):309 -311
Toxicological data
None yet
Ecological data
None yet
Molecular structure data
5. Molecular property data:
1、 Moore Refractive index: 60.87
2、 Moore Volume (m3/mol):183.8
3、 Isotonic specific volume (90.2K) ：464.5
4、 Surface Tension (dyne/cm):40.7
5、 2、 Molar volume (m 3/mol）：183.8
3、 Isotonic specific volume (90.2K) ：464.5
4、 Surface Tension (dyne/cm):40.7
5、 Polarizability (10-24cm3):24.13
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 0
3. Number of hydrogen bond acceptors: 1
4. Number of rotatable chemical bonds: 2
5. Number of tautomers: none
6. Topological molecule polar surface area 17.1
7. Number of heavy atoms: 15
8. Surface charge: 0
9. Complexity: 215
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
Usage
Pharmaceutical intermediates.
�; mso-font-kerning: 0pt; mso-ascii-font-family: Arial; mso-hansi-font-family: Arial; mso-bidi-font-family: Arial”>Polarizability (10-24cm3 ):24.13
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 0
3. Number of hydrogen bond acceptors: 1
4. Number of rotatable chemical bonds: 2
5. Number of tautomers: none
6. Topological molecule polar surface area 17.1
7. Number of heavy atoms: 15
8. Surface charge: 0
9. Complexity: 215
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
Usage
Pharmaceutical intermediates.
