desipramine hydrochloride desipramine hydrochloride

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:58-28-6

mdl number:mfcd00058108

einecs number:200-373-1

rtecs number:ho0525000

brn number:none

pubchem number:24278094

physical property data

1. properties: white to off-white powder. ^[1]

2. solubility: h2o: soluble 50 mg/ml. ^[2]

toxicological data

none

ecological data

none

molecular structure data

1. molar refractive index: 84.16

2. molar volume (cm³/mol): 254.2

3. isotonic specific volume (90.2k ): 639.3

4. surface tension (dyne/cm): 39.9

5. polarizability (10^-24cm³): 33.36

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: 2

4. number of rotatable chemical bonds: 4

5. number of tautomers: none

6. topological molecule polar surface area 15.3

7. number of heavy atoms: 21

8. surface charge: 0

9. complexity: 267

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: 2

properties and stability

1. storage temperature: 2-8°c ^[3]

storage method

synthesis method

prepared from dibenzazepine as raw material.

purpose

biochemical research. medical antidepressants.