Ethyl 2-(2,4-dichlorophenoxy)heptanoate
Basic information
- CAS
7462-16-0- Standard SMILES
CCCCCC(Oc1ccc(Cl)cc1Cl)C(=O)OCC- InChIKey
TXXLNSFJTZKNCK-UHFFFAOYSA-N- Molecular formula
- C15H20Cl2O3
- Average molar mass
- 319.2 g/mol
- Monoisotopic mass
- 318.0789499
Names & identifiers
- Preferred name
- Ethyl 2-(2,4-dichlorophenoxy)heptanoate
- IUPAC
- ethyl 2-(2,4-dichlorophenoxy)heptanoate
Names & synonyms
7462-16-0ethyl 2-(2,4-dichlorophenoxy)heptanoateNSC404171DTXSID50323514NSC-404171
Database identifiers
- CAS
7462-16-0- PubChem CID
- 346121
- DTXSID
DTXSID50323514
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 286
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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