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77279-89-1 | Benzoic acid,4-fluoro-3-phenoxy-
CAS No: 77279-89-1 Catalog No: AG005D05 MDL No:MFCD03617287
Product Description
Catalog Number:
AG005D05
Chemical Name:
Benzoic acid,4-fluoro-3-phenoxy-
CAS Number:
77279-89-1
Molecular Formula:
C13H9FO3
Molecular Weight:
232.2072
MDL Number:
MFCD03617287
IUPAC Name:
4-fluoro-3-phenoxybenzoic acid
InChI:
InChI=1S/C13H9FO3/c14-11-7-6-9(13(15)16)8-12(11)17-10-4-2-1-3-5-10/h1-8H,(H,15,16)
InChI Key:
VLXNXMTVRWIUJZ-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c(c1)Oc1ccccc1)F
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.054g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
232.21g/mol
Monoisotopic Mass:
232.054g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
Literature
| Title | Journal |
|---|---|
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| Review of pesticide urinary biomarker measurements from selected US EPA children's observational exposure studies. | International journal of environmental research and public health 20110501 |
| Urinary concentrations of metabolites of pyrethroid insecticides in the general U.S. population: National Health and Nutrition Examination Survey 1999-2002. | Environmental health perspectives 20100601 |
| Derivation of Biomonitoring Equivalents for cyfluthrin. | Regulatory toxicology and pharmacology : RTP 20091201 |
| Assessment of exposure to pyrethroids and pyrethrins in a rural population of the Montérégie area, Quebec, Canada. | Journal of occupational and environmental hygiene 20090601 |
| Biological monitoring of exposure to pyrethrins and pyrethroids in a metropolitan population of the Province of Quebec, Canada. | Environmental research 20080701 |
| Pest controllers: a high-risk group for Multiple Chemical Sensitivity (MCS)? | Clinical toxicology (Philadelphia, Pa.) 20080301 |
| Simultaneous determination of pyrethroid and pyrethrin metabolites in human urine by gas chromatography-high resolution mass spectrometry. | Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20050125 |
| Isotope dilution high-performance liquid chromatography-tandem mass spectrometry method for quantifying urinary metabolites of synthetic pyrethroid insecticides. | Archives of environmental contamination and toxicology 20040401 |
| Current internal exposure to pesticides in children and adolescents in Germany: urinary levels of metabolites of pyrethroid and organophosphorus insecticides. | International archives of occupational and environmental health 20040101 |
| Biological monitoring of workers after the application of insecticidal pyrethroids. | International archives of occupational and environmental health 20030901 |
| Human exposure to indoor residential cyfluthrin residues during a structured activity program. | Journal of exposure analysis and environmental epidemiology 20030301 |
| New gas chromatographic-mass spectrometric method for the determination of urinary pyrethroid metabolites in environmental medicine. | Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20021005 |
| Pyrethroid exposure of the general population-is this due to diet. | Toxicology letters 20020805 |
| Metabolites of pyrethroid insecticides in urine specimens: current exposure in an urban population in Germany. | Environmental health perspectives 20010301 |
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