3-indole acetate
Structural formula
| Business number | 06A3 |
|---|---|
| Molecular formula | C10H9NO2 |
| Molecular weight | 175.18 |
| label |
indole acetate, Indoxyl hydrochloride, 3-Indoxyl acetate, β-indolizine acetate, Hydroxyindole acetate, Acetic acid oxidizes indole, Indoxyl acetate, Indoxyl acetate |
Numbering system
CAS number:608-08-2
MDL number:MFCD00014561
EINECS number:210-154-2
RTECS number:AI3325000
BRN number:143086
PubChem number:24896038
Physical property data
1. Physical property data
Melting point :128-131°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 property data:
1, Molar refractive index:49.86
2, Molar volume (m3/mol):139.5
3, Isotonic specific volume (90.2K ):372.2
4, Surface tension (dyne/ cm):50.6
5、 Polarizability (10-24cm3): 19.76
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond acceptors: 2
4. Number of rotatable chemical bonds: 2
5. Number of tautomers: none
6. Topological molecule polar surface area 42.1
7. Number of heavy atoms: 13
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:
No decomposition products may occur under normal temperatures and pressures.
Storage method
Storage:
Seal the secret device, Store in a sealed main container in a cool place Dry position.
Synthesis method
None yet
Purpose
None yet
