Structural formula
| Business number | 0140 |
|---|---|
| Molecular formula | C10H12N2O |
| Molecular weight | 176.22 |
| label |
3-(2-aminoacetic acid) indole, Beta-sitosterol, Beta-food sterol, encephalamine, 3-(2-Aminoethyl)indole-5-ol, 5-Hydroxytryptamine, 3-(2-Aminoethyl)-5-oxyindole, 3-(2-Aminoethyl)-1H-indol-5-ol, Serotonine, Thrombotonin |
Numbering system
CAS number:50-67-9
MDL number:None
EINECS number:200-058-9
RTECS number:None
BRN number:None
PubChem ID:None
Physical property data
1. Properties: Uncertain
2. Density (g/mL, 25/4?): Uncertain
3. Relative vapor density (g/mL, air =1): Uncertain
4. Melting point (ºC): Uncertain
5. Boiling point (ºC, normal pressure): Uncertain
6. Boiling point (ºC, 5.2 kPa): Uncertain
7. Refractive index: Uncertain
8. Flash point (ºC): Uncertain
9. Specific rotation (º): Uncertain
10. Autoignition point or ignition temperature (ºC): Uncertain
11. Vapor pressure (kPa, 25 ºC): Uncertain
12. Saturated vapor pressure (kPa, 60 ºC): Uncertain
13. Heat of combustion (KJ/mol): Uncertain
14. Critical Temperature (ºC): Uncertain
15. Critical pressure (KPa): Uncertain
16. Log value of oil-water (octanol/water) partition coefficient: Uncertain
15. p>
17. Explosion upper limit (%, V/V): Uncertain
18. Explosion lower limit (%, V/V): Uncertain
19. Dissolution Sex: Unsure
Toxicological data
None
Ecological data
None
Molecular structure data
1. Molar refractive index: 53.49
2. Molar volume (cm3/mol): 136.7
3. Isotonic specific volume (90.2K ): 391.3
4. Surface tension (dyne/cm): 66.9
5. Polarizability (10-24cm3): 21.20
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 3
3.Number of hydrogen bond acceptors: 2
4.Number of rotatable chemical bonds: 2
5.Number of tautomers: 9
6.Topology Molecular polar surface area 62
7. Number of heavy atoms: 13
8. Surface charge: 0
9. Complexity: 174
10. Number of isotope atoms: 0
11. Number of determined atomic stereocenters: 0
12. Number of uncertain atomic stereocenters: 0
13. Determine the number of stereocenters of chemical bonds: 0
14. Uncertain number of stereocenters of chemical bonds: 0
15. Number of covalent bond units: 1
Properties and stability
None
Storage method
None
Synthesis method
None
Purpose
None
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