Propyl 2,4,5-trichlorophenoxyacetate
Basic information
- CAS
1928-40-1- Standard SMILES
CCCOC(=O)COc1cc(Cl)c(Cl)cc1Cl- InChIKey
KQPZLIOOEZZUFO-UHFFFAOYSA-N- Molecular formula
- C11H11Cl3O3
- Average molar mass
- 297.6 g/mol
- Monoisotopic mass
- 295.977377
Names & identifiers
- Preferred name
- Propyl 2,4,5-trichlorophenoxyacetate
- IUPAC
- propyl 2-(2,4,5-trichlorophenoxy)acetate
- English name
- propyl 2,4,5-trichlorophenoxyacetate
- Molecular formula
- C11H11Cl3O3
- Molecular weight
- 297.56224
Names & synonyms
propyl 2-(2,4,5-trichlorophenoxy)acetatePropyl 2,4,5-trichlorophenoxyacetate1928-40-12,4,5-T, propyl esterpropyl 2,4,5-trichloro-phenoxyacetateEINECS 217-672-8DTXSID20940954AKOS017265344propyl (2,4,5-trichlorophenoxy)acetateNS00046271n-Propyl ester of 2,4,5-trichlorophenoxy acetic acid2,4,5-Trichlorophenoxyacetic acid propyl ester
Database identifiers
- CAS
1928-40-1- PubChem CID
- 74727
- DTXSID
DTXSID20940954- EC Number
- 217-672-8
- Nikkaji
- J199.747E
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 250
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Physicochemical properties
- Boiling point
- 344.42 °C · 344.42°C (rough estimate)
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Compound notes
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