Basic information
- Standard SMILES
Oc1ccc(Oc2ncc(C(F)(F)F)cc2Cl)cc1- InChIKey
NMJNUBBLJFJUKE-UHFFFAOYSA-N- Molecular formula
- C12H7ClF3NO2
- Average molar mass
- 289.64 g/mol
- Monoisotopic mass
- 289.0117408
Names & identifiers
- Preferred name
- 4-(3-Chloro-5-(trifluoromethyl)pyridin-2-yl)oxyphenol
- IUPAC
- 4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenol
Names & synonyms
DTXSID4010286434-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenol4-(3-Chloro-5-(trifluoromethyl)pyridin-2-yl)oxyphenolRefChem:1069888DTXCID301514235Haloxyfop-phenol69045-89-24-[(3-Chloro-5-trifluoromethylpyridin-2-yl)oxy]phenol4-[[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenol; 2-(4'-Hydroxyphenoxy)-3-chloro-5-(trifluoromethyl)pyridine; 4-[(3-Chloro-5-trifluoromethylpyridin-2-yl)oxy]phenolDE-535 PhenolHaloxyfop-phenol MetaboliteSCHEMBL5687596
Show more names
SCHEMBL11196331SCHEMBL31251923NS00040783Haloxyfop-phenol 100 |Ig/mL in AcetonitrileHaloxyfop-phenol 100 microg/mL in AcetonitrileAK-105/408347264-(3-chloro-5-trifluoromethyl-2-pyridyloxy)phenol3-chloro-2-p-hydroxyphenoxy-5-trifluoro methylpyridine
Database identifiers
- PubChem CID
- 9795997
- DTXSID
DTXSID401028643
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 42.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 295
Experimental & physicochemical properties
PesticidesEnvironmental transformation -> Pesticide transformation products (metabolite, successor)
Chemistry & industry
Uses & manufacturing
Use ClassificationEnvironmental transformation -> Pesticide transformation products (metabolite, successor)
Related reactions
16 records
Compound notes
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