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