n-ω-methyltryptamine n-ω-methyltryptamine

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:61-49-4

mdl number:mfcd00005657

einecs number:200-507-9

rtecs number:nm0450000

brn number:none

pubchem number:24847209

physical property data

none yet

toxicological data

1, acute toxicity: mouse abdominal cavity ld50: 158mg/kg

ecological data

none yet

molecular structure data

5. molecular property data:

1. molar refractive index: 56.30

2. molar volume (m³/mol):160.0

3. isotonic specific volume (90.2k):415.0

4. surface tension (dyne/cm):45.2

5. polarizability（10^-24cm³): 22.32

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: 3

5. number of tautomers: none

6. topological molecule polar surface area 27.8

7. number of heavy atoms: 13

8. surface charge: 0

9. complexity: 158

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

none yet

storage method

none yet

synthesis method

none yet

purpose

none yet