1-methylindole
Structural formula
| Business number | 0681 |
|---|---|
| Molecular formula | C9H9N |
| Molecular weight | 131.17 |
| label |
N-methylindole |
Numbering system
CAS number:603-76-9
MDL number:MFCD00005800
EINECS number:210-057-5
RTECS number:None
BRN number:111026
PubChem number:24851625
Physical property data
Physical property data:
1. Density (g/mL ,25/4℃):1.026
2. Refractive index (nD20):1.606-1.608
3. Boiling point (ºC): 236-239
4. Solubility: insoluble in water
Toxicological data
None
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:42.69 2, Molar volume ( m3/mol):130.1 3, Isotonic specific volume (90.2K ):318.8 4, Surface tension (dyne/ cm):36.0 5、 Polarizability (10-24cm3): 16.92
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: 0
4. Number of rotatable chemical bonds: 0
5. Number of tautomers: none
6. Topological molecule polar surface area 4.9
7. Number of heavy atoms: 10
8. Surface charge: 0
9. Complexity: 122
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
Purpose
None