
structural formula
| business number | 0260 | 
|---|---|
| molecular formula | c12h12o2 | 
| molecular weight | 182.22 | 
| label | 2-(β-hydroxyethoxy)naphthalene | 
numbering system
cas number:93-20-9
mdl number:mfcd00016809
einecs number:202-228-8
rtecs number:none
brn number:2086973
pubchem id:none
physical property data
none
toxicological data
none
ecological data
none
molecular structure data
1. molar refractive index: 56.94
2. molar volume (cm3/mol): 161.5
3. isotonic specific volume (90.2k ): 424.2
4. surface tension (dyne/cm): 47.5
5. polarizability (10-24cm3): 22.57
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: 3
5. number of tautomers: none
6. topological molecule polar surface area 29.5
7. number of heavy atoms: 14
8. surface charge: 0
9. complexity: 170
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
storage method
none
synthesis method
none
purpose
none

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