n-ethyl-p-toluenesulfonamide n-ethyl-p-toluenesulfonamide

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:80-39-7

mdl number:mfcd00048511

einecs number:201-275-1

rtecs number:none

brn number:none

pubchem number:24865996

physical property data

1. characteristics: this product is white crystal

2. density (g/ml,25/4℃): unsure

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

4. melting point (ºc):63 -65°c

5. boiling point (ºc,normal pressure):208°c (745 mm hg)

6. boiling point (ºc,5.2kpa): unsure

7. refractive index: uncertain

8. flashpoint (ºc): 126
9. specific optical activity degree (º): not sure

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

11. vapor pressure (kpa,25ºc): unsure

12. saturated vapor pressure (kpa,60ºc): unsure

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

19. solubility: soluble in ethanol, insoluble in water and ether

toxicological data

none yet

ecological data

none yet

molecular structure data

1. molar refractive index: 53.10

2. molar volume (m³/mol）：172.8

3. isotonic specific volume (90.2k):429.9

4. surface tension (dyne/cm):38.3

5. polarizability（10^-24cm³):21.05

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: 3

5. number of tautomers: none

6. topological molecule polar surface area 54.6

7. number of heavy atoms: 13

8. surface charge: 0

9. complexity: 235

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 sealedshadysave.

synthesis method

none yet

purpose

plasticizer. it can also be used in organic synthesis and pharmaceuticals.

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5. polarizability（10^-24cm³):21.05

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: 3

5. number of tautomers: none

6. topological molecule polar surface area 54.6

7. number of heavy atoms: 13

8. surface charge: 0

9. complexity: 235

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 sealedshadysave.

synthesis method

none yet

purpose

plasticizer. it can also be used in organic synthesis and pharmaceuticals.