structural formula
| business number | 022p |
|---|---|
| molecular formula | c12h22o10 |
| molecular weight | 326.30 |
| label |
rue sugar, 6-o-(6-deoxy-α-l-oligopyranyl)-d-glucose, 6-o-(α-l-rhamnopyranosyl)-d-glucose, 6-o-(6-deoxy-α-l-mannopyranosyl)-d-glucose |
numbering system
cas number:90-74-4
mdl number:mfcd00161473
einecs number:202-014-4
rtecs number:none
brn number:none
pubchem id:none
physical property data
none
toxicological data
none
ecological data
none
molecular structure data
1. molar refractive index: 69.26
2. molar volume (cm3/mol): 196.2
3. isotonic specific volume (90.2k ): 611.3
4. surface tension (dyne/cm): 94.1
5. polarizability (10-24cm3): 27.46
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): -4.2
2. number of hydrogen bond donors: 7
3. number of hydrogen bond acceptors: 10
p>
4. number of rotatable chemical bonds: 3
5. number of tautomers:
6. topological molecular polar surface area (tpsa): 169
p>
7. number of heavy atoms: 22
8. surface charge: 0
9. complexity: 368
10. number of isotope atoms : 0
11. determine the number of atomic stereocenters: 10
12. uncertain number of atomic stereocenters: 0
13. determine the chemical bond configuration number of centers: 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
