
structural formula
| business number | 06gr |
|---|---|
| molecular formula | c8h16n2o3 |
| molecular weight | 188.22 |
| label |
none yet |
numbering system
cas number:615-82-7
mdl number:none
einecs number:210-449-6
rtecs number:none
brn number:none
pubchem id:none
physical property data
none yet
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:47.75
2, molar volume (m3/mol):165.5
3, isotonic specific volume (90.2k ):429.0
4, surface tension (dyne/ cm):45.0
5、 polarizability (10-24cm3): 18.93
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): -2.3
2. number of hydrogen bond donors: 3
3. number of hydrogen bond acceptors: 4
4. number of rotatable chemical bonds: 5
5 .number of tautomers: 2
6. topological molecule polar surface area 92.4
7. number of heavy atoms: 13
8. surface charge: 0
9. complexity: 192
10. number of isotope atoms: 0
11. determine the number of atomic stereocenters: 0
12. uncertain number of atomic stereocenters: 1
13. determined number of chemical bond stereocenters: 0
14. uncertain number of 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

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