structural formula
business number | 069w |
---|---|
molecular formula | c11h12o3 |
molecular weight | 192.21 |
label |
5-methoxysassafras olein, nutmeg essence, 5-allyl-2,3-(methylenedioxy)anisole, synergene, 4-methoxy-6-(2-propenyl)-2,3-benzodioxole, 5-allyl-1-methoxy-2,3-(methylenedioxy)benzene, pesticides |
numbering system
cas number:607-91-0
mdl number:mfcd00133549
einecs number:210-146-9
rtecs number:cy2625000
brn number:166218
pubchem number:24846264
physical property data
1. melting point (ºc): -30
2. boiling point (ºc): 149~149.6 (2kpa)
3. relative density (20℃, 4℃) : 1.135
4. relative density (25℃, 4℃): 0.9943
5. refractive index at room temperature (n20): 1.5412
6. refractive index at room temperature (n25): 1.5395
toxicological data
none yet
ecological data
3. ecological data:
1. other harmful effects: this substance may be harmful to the environment, and special attention should be paid to water bodies.
molecular structure data
5. molecular property data:
1. molar refractive index: 53.00
2. molar volume (cm3/mol): 169.0
3. isotonic specific volume (90.2k): 424.6
4. surface tension (dyne/cm): 69.8
5. polarizability (10-24cm3): 21.01
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: 3
4. number of rotatable chemical bonds: 3
5. number of tautomers: none
6. topological molecule polar surface area 27.7
7. number of heavy atoms: 14
8. surface charge: 0
9. complexity: 205
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:
1. the product may not decompose under normal temperature and pressure.
2. exist in smoke.
3. it has an exciting effect on the human brain.
storage method
storage:
seal the container and store it in a sealed main container in a cool, dry place.
synthesis method
none yet
purpose
none yet