n,n-bis(2-hydroxyethyl)-3-chloroaniline

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:92-00-2

mdl number:mfcd00002852

einecs number:202-115-3

rtecs number:kk2420000

brn number:none

pubchem id:none

physical property data

none yet

toxicological data

none yet

ecological data

none yet

molecular structure data

1. molar refractive index: 57.79

2. molar volume (cm³/mol): 167.4

3. isotonic specific volume (90.2k ): 458.1

4. surface tension (dyne/cm): 56.1

5. polarizability (10-24cm3): 22.91

compute chemical data

1. reference value for hydrophobic parameter calculation (xlogp): 1.3

2. number of hydrogen bond donors: 2

3. number of hydrogen bond acceptors: 3

4. number of rotatable chemical bonds: 5

5. number of tautomers: none

6. topological molecule polar surface area 43.7

7. number of heavy atoms: 14

8. surface charge: 0

9. complexity: 151

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

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purpose

none yet