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.
