structural formula
business number | 06a1 |
---|---|
molecular formula | c11h14n2o |
molecular weight | 190.24 |
label |
none yet |
numbering system
cas number:608-07-1
mdl number:mfcd00005662
einecs number:210-153-7
rtecs number:nl4059000
brn number:145587
pubchem number:24857245
physical property data
1. physical property data
melting point :121-123°c
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 properties��data:
1, molar refractive index:58.29
2, molar volume (m3/mol):162.3
3, isotonic specific volume (90.2k ):433.0
4, surface tension (dyne/ cm):50.5
5、 polarizability (10 -24cm3):23.10
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): none
2. number of hydrogen bond donors: 2
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 51
7. number of heavy atoms: 14
8. surface charge: 0
9. complexity: 186
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