structural formula
business number | 069u |
---|---|
molecular formula | c14h12o3 |
molecular weight | 228.24 |
label |
2-hydroxybenzoic acid-4-methylbenzyl ester |
numbering system
cas number:607-88-5
mdl number:none
einecs number:210-144-8
rtecs number:vo6800000
brn number:none
pubchem id:none
physical property data
1. physical property data
1 . melting point:38℃
toxicological data
none yet
ecological data
3. ecological data:
1. other harmful effects: this substance may be harmful to the environment and should be harmful to water bodies. give special attention.
molecular structure data
5. molecular property data:
1, molar refractive index:64.60
2, molar volume (m3/mol):187.5
3, isotonic specific volume (90.2k ):497.3
4, surface tension (dyne/ cm):49.4
5、 polarizability (10– 24cm3):25.61
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: 3
4. number of rotatable chemical bonds: 3
5. number of tautomers: 4
6. topological molecule polar surface area 46.5
7. number of heavy atoms: 17
8. surface charge: 0
9. complexity: 256
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
properties and stability:
no decomposition products may occur under normal temperatures and pressures.
storage method
storage:
seal the secret container and store it in a sealed main container in a cool place dry position.
synthesis method
none yet
purpose
none yet