Ethyl (4-chloro-3,5-dimethylphenoxy)acetate
Basic information
- CAS
167995-29-1- Standard SMILES
CCOC(=O)COc1cc(C)c(Cl)c(C)c1- InChIKey
BYHLSWXJCVEMBA-UHFFFAOYSA-N- Molecular formula
- C12H15ClO3
- Average molar mass
- 242.7 g/mol
- Monoisotopic mass
- 242.070972
Names & identifiers
- Preferred name
- Ethyl (4-chloro-3,5-dimethylphenoxy)acetate
- IUPAC
- ethyl 2-(4-chloro-3,5-dimethylphenoxy)acetate
- English name
- Acetic acid, 2-(4-chloro-3,5-dimethylphenoxy)-, ethyl ester
- Molecular formula
- C12H15ClO3
- Molecular weight
- 242.7
Names & synonyms
167995-29-1ethyl (4-chloro-3,5-dimethylphenoxy)acetateethyl 2-(4-chloro-3,5-dimethylphenoxy)acetateAcetic acid, (4-chloro-3,5-dimethylphenoxy)-, ethyl esterST50184467Acetic acid, 2-(4-chloro-3,5-dimethylphenoxy)-, ethyl esterDTXSID20351445ALBB-038762AKOS001595301H82043SR-01000405601SR-01000405601-1
Database identifiers
- CAS
167995-29-1- PubChem CID
- 700499
- DTXSID
DTXSID20351445
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 220
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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