3,4-dimethoxybenzoylmethylamine (3,4-dimethoxybenzyl)methylamine

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:63-64-9

mdl number:mfcd00837593

einecs number:none

rtecs number:none

brn number:none

pubchem number:24882383

physical property data

1. character: uncertain

2. density (g/ml,25/4℃):0.951

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

4. melting point (ºc): unsure

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

6. boiling point (ºc, 0.5mmhg):103-106

7. refractive index:1.5410

8. flash point (ºf): >230

9. specific optical rotation (º): unsure

10. autoignition point or ignition temperature (ºc): unsure

11. vapor pressure (kpa,25ºc): unsure

12. saturated vapor pressure (kpa,60ºcexplosion limit (%,v/v): unsure

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

19. solubility:not sure

toxicological data

none yet

ecological data

none yet

molecular structure data

1. molar refractive index: 52.75

2. molar volume (m³/mol）：179.0

3. isotonic specific volume (90.2k):425.1

4. surface tension (dyne/cm):31.7

5. polarizability（10^-24cm³):20.91

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: 3

4. number of rotatable chemical bonds: 4

5. number of tautomers: none

6. topological molecule polar surface area 30.5

7. number of heavy atoms: 13

8. surface charge: 0

9. complexity: 141

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

this product should be sealed and stored in a cool, dry place.

synthesis method

none yet

purpose

none yet

nbsp; isotonic specific volume (90.2k):425.1

4. surface tension (dyne/cm):31.7

5. polarizability（10^-24cm³):20.91

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: 3

4. number of rotatable chemical bonds: 4

5. number of tautomers: none

6. topological molecule polar surface area 30.5

7. number of heavy atoms: 13

8. surface charge: 0

9. complexity: 141

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

this product should be sealed and stored in a cool, dry place.

synthesis method

none yet

purpose

none yet