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
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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
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Synthesis method
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Purpose
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