2,3-dichloropropionic acid
structural formula
| business number | 05tb |
|---|---|
| molecular formula | c3h4cl2o2 |
| molecular weight | 142.97 |
| label |
none |
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
