6-isopropylquinoline
structural formula
| business number | 03ql |
|---|---|
| molecular formula | c12h13n |
| molecular weight | 171.24 |
| label |
6-(1-methylethyl)quinoline, isopropylquinoline, 6-(1-methylethyl)-quinolin, aromatic compounds |
numbering system
cas number:135-79-5
mdl number:mfcd00047615
einecs number:205-220-2
rtecs number:none
brn number:none
pubchem id:none
physical property data
none
toxicological data
none
ecological data
none
molecular structure data
molecular property data:
1、 molar refractive index：56.37
2、 molar volume(m3 / mol):166.8
3、 isotonic specific volume（90.2k）：420.2
4、 surface tension（3.0 dyne/cm span>):40.2
5、 polarizability（ 0.5 10-24cm3): 22.34
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: 1
5. number of tautomers: none
6. topological molecule polar surface area 12.9
7. number of heavy atoms: 13
8. surface charge: 0
9. complexity: 165
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
” numbertype=”1″ tcsc=”0″ w:st=”on”>-24cm3):22.34
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: 1
5. number of tautomers: none
6. topological molecule polar surface area 12.9
7. number of heavy atoms: 13
8. surface charge: 0
9. complexity: 165
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
