tryptamine tryptamine

structural formula

• numbering system
• physical property data
• toxicological data
• ecological data
• molecular structure data
• computing chemical data
• more
  • properties and stability
  • storage method
  • synthesis method
  • purpose

numbering system

cas number:61-54-1

mdl number:mfcd00005661

einecs number:200-510-5

rtecs number:nl4020000

brn number:125513

pubchem number:24851608

physical property data

1. properties: white needle-like crystals. sensitive to light and air.

2. density (g/ml, 25/4℃): undetermined

3. relative vapor density (g/ml, air=1): undetermined

4. melting point (ºc): 118℃ (decomposes at 145~146℃)

5. boiling point (ºc, normal pressure): undetermined

6. boiling point ( ºc, 20kpa): 137

7. refractive index: not determined

8. flash point (ºc): 1859. specific rotation (º): not determined

10. autoignition point or ignition temperature (ºc): not determined

11. vapor pressure (kpa, 25ºc): not determined

12. saturated vapor pressure (kpa, 60ºc): not determined

13. heat of combustion (kj/mol): undetermined

14. critical temperature (ºc): undetermined

15. critical pressure (kpa): undetermined

16. log value of oil-water (octanol/water) partition coefficient: undetermined

17. explosion upper limit (%, v/v): undetermined

18. lower explosion limit (%, v/v): undetermined

19. solubility: soluble in ethanol and acetone, almost insoluble in ether, benzene, chloroform and water.

toxicological data

1. acute toxicity: rat intraperitoneal ld50: 223mg/kg; mouse intraperitoneal ld50: 100mg/kg; mouse subcutaneous ld50: 500mg/kg

ecological data

none yet

molecular structure data

1. molar refractive index: 51.61

2. molar volume (cm³/mol): 138.3

3. isotonic specific volume (90.2k ): 376.3

4. surface tension (dyne/cm): 54.7

5. polarizability (10-24cm3): 20.46

compute chemical data

1. reference value for hydrophobic parameter calculation (xlogp): none

2. number of hydrogen bond donors: 2

3. number of hydrogen bond acceptors: 1

4. number of rotatable chemical bonds: 2

5. number of tautomers: none

6. topological molecule polar surface area 41.8

7. number of heavy atoms: 12

8. surface charge: 0

9. complexity: 147

10. number of isotope atoms: 0

11. determine the atomic configurationnumber of stereocenters: 0

12. uncertain number of stereocenters of atoms: 0

13. determined number of stereocenters of chemical bonds: 0

14. no determine the number of stereocenters of chemical bonds: 0

15. the number of covalent bond units: 1

properties and stability

none yet

storage method

this product should be sealed and stored dry at 4°c.

synthesis method

none yet

purpose

biochemical research. ​