2,3-dichloropropionic acid

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:565-64-0

mdl number:mfcd00021695

einecs number:c3h4cl2o2

rtecs number:uf0700000

brn number:1721427

pubchem number:24862195

physical property data

1. physical property data

1. melting point: 50℃.

2. boiling point: 210℃.

toxicological data

none yet

ecological data

none yet

molecular structure data

5. molecular property data:

1. molar refractive index: 27.16

2. molar volume (cm³/mol): 95.8

3. isotonic specific volume (90.2k): 247.5

4. surface tension (dyne/cm): 44.5

5. polarizability (10^-24cm³): 10.77

compute chemical data

iv. calculated chemical data:

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

2. number of hydrogen bond donors: 1

3. number of hydrogen bond acceptors: 2

4. number of rotatable chemical bonds: 2

5. topological molecular polar surface area (tpsa): 37.3

6. number of heavy atoms: 7

7. surface charge: 0

8. complexity: 73.3

9. number of isotope atoms: 0

10. determine the number of atomic stereocenters: 0

11. uncertain number of atomic stereocenters: 1

12. determine the number of chemical bond stereocenters: 0

13. the number of uncertain stereocenters of chemical bonds: 0

14. the number of covalent bond units: 1

properties and stability

none yet

storage method

none yet

synthesis method

none yet

purpose

none yet