2-(3,4,5-Trichlorophenoxy)butanoyl chloride
Basic information
- CAS
61994-00-1- Standard SMILES
CCC(Oc1cc(Cl)c(Cl)c(Cl)c1)C(=O)Cl- InChIKey
GSNBCAYZKDIONI-UHFFFAOYSA-N- Molecular formula
- C10H8Cl4O2
- Average molar mass
- 302 g/mol
- Monoisotopic mass
- 299.92784
Names & identifiers
- Preferred name
- 2-(3,4,5-Trichlorophenoxy)butanoyl chloride
- IUPAC
- 2-(3,4,5-trichlorophenoxy)butanoyl chloride
Names & synonyms
2-(3,4,5-Trichlorophenoxy)butanoyl chloride61994-00-1SCHEMBL11755431DTXSID60614682
Database identifiers
- CAS
61994-00-1- PubChem CID
- 21488071
- DTXSID
DTXSID60614682
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 237
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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