2,4-Dimethylphenyl 2-(2,4,5-trichlorophenoxy)propanoate
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Basic information
- CAS
723758-08-5- Standard SMILES
Cc1ccc(OC(=O)C(C)Oc2cc(Cl)c(Cl)cc2Cl)c(C)c1- InChIKey
ULXMLEUXPYIORS-UHFFFAOYSA-N- Molecular formula
- C17H15Cl3O3
- Average molar mass
- 373.7 g/mol
- Monoisotopic mass
- 372.008677
Names & identifiers
- Preferred name
- 2,4-Dimethylphenyl 2-(2,4,5-trichlorophenoxy)propanoate
- IUPAC
- (2,4-dimethylphenyl) 2-(2,4,5-trichlorophenoxy)propanoate
- English name
- 2,4-dimethylphenyl 2-(2,4,5-trichlorophenoxy)propanoate
- Molecular formula
- C17H15Cl3O3
- Molecular weight
- 373.66
Names & synonyms
2,4-dimethylphenyl 2-(2,4,5-trichlorophenoxy)propanoate(2,4-dimethylphenyl) 2-(2,4,5-trichlorophenoxy)propanoateAN-652/42190631Propanoic acid, 2-(2,4,5-trichlorophenoxy)-, 2,4-dimethylphenyl ester
Database identifiers
- CAS
723758-08-5- PubChem CID
- 4604774
Properties
Computed structural propertiesFilling in
- XLogP
- 6.4
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 407
Physicochemical properties
- Boiling point
- 472.5 · 472.5±45.0 °C(Predicted)
- Density
- 1.33 · 1.330±0.06 g/cm3(Predicted)
Related reactions
0 records
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Compound notes
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