2-(isopropylamino)ethanol 2-(isopropylamino)ethanol

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:109-56-8

mdl number:mfcd00041755

einecs number:203-681-4

rtecs number:kl5080000

brn number:1633453

pubchem number:24870646

physical property data

1. properties: undetermined

2. density (g/ml, 25℃): 0.92

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

4. melting point (ºc): undetermined

5. boiling point (ºc, normal pressure): 172

6. boiling point (ºc, kpa): undetermined

7. refractive index: 1.441

8. flash point (ºc): 78

9. specific rotation (º): not determined

10. autoignition point or ignition temperature (ºc): not determined

11. vapor pressure (mmhg, 20ºc): not determined

12 . saturated vapor pressure (kpa, ºc): undetermined

13. heat of combustion (kj/mol): undetermined

14. critical temperature (ºc): undetermined

p>

15. critical pressure (kpa): undetermined

16. log value of oil-water (octanol/water) partition coefficient: undetermined

17. explosion upper limit (%, v/v): undetermined

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

19. solubility: undetermined

toxicological data

1. acute toxicity: mouse oral ld50: 1250mg/kg

2. reproductive toxicity: rat oral tdlo: 50mg/kg (5 days after conception in female rats)

ecological data

none yet

molecular structure data

1. molar refractive index: 30.30

2. molar volume (cm³/mol): 117.7

3. isotonic specific volume (90.2k ): 273.1

4. surface tension (dyne/cm): 28.9

5. polarizability (10-24cm3): 12.01

calculate chemical data

1. reference value for hydrophobic parameter calculation (xlogp): -0.1

2. number of hydrogen bond donors: 2

3. number of hydrogen bond acceptors: 2

p>

4. number of rotatable chemical bonds: 3

5. number of tautomers: none

6. topological molecule polar surface area 32.3

7. number of heavy atoms: 7

8. surface charge: 0

9. complexity: 37.1

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