Butyl 2-(4-(4-cyano-2-fluorophenoxy)phenoxy)propanoate
Basic information
- Standard SMILES
CCCCOC(=O)C(C)Oc1ccc(Oc2ccc(C#N)cc2F)cc1- InChIKey
TYIYMOAHACZAMQ-UHFFFAOYSA-N- Molecular formula
- C20H20FNO4
- Average molar mass
- 357.4 g/mol
- Monoisotopic mass
- 357.13763628
Overview
See also: Cyhalofop-butyl (annotation moved to).
Names & identifiers
- Preferred name
- Butyl 2-(4-(4-cyano-2-fluorophenoxy)phenoxy)propanoate
- IUPAC
- butyl 2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate
Names & synonyms
122008-82-6Propanoic acid, 2-[4-(4-cyano-2-fluorophenoxy)phenoxy]-, butyl esterbutyl 2-(4-(4-cyano-2-fluorophenoxy)phenoxy)propanoatebutyl 2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoateBUTYL 2-[4-(4-CYANO-2-FLUORO-PHENOXY)PHENOXY]PROPANOATECyhalofop ButylClincher; Clincher CA;XDE 537SCHEMBL56021DTXSID50861269MFCD09832888AKOS015896064AS-72333
Show more names
D92876F843894butyl2-(4-(4-cyano-2-fluorophenoxy)phenoxy)propanoate
Database identifiers
- PubChem CID
- 86188
- DTXSID
DTXSID50861269
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 68.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 483
Experimental & physicochemical properties
PesticidesPesticide (Cyhalofop butyl) -> USDA PDB
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Related reactions
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Compound notes
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