2-(4-Chlorophenoxy)acetic Acid - CAS 122-88-3
Catalog: |
BB055568 |
Product Name: |
2-(4-Chlorophenoxy)acetic Acid |
CAS: |
122-88-3 |
Synonyms: |
2-(p-Chlorophenoxy)acetic Acid; 4-CP; 4-CPA; BI 12; HP 55; NSC 8769; NSC 9213; P 10; PCPA; Tomatone; Tomatotone; p-CPA; (4-Chlorophenoxy)acetic Acid; (p-Chlorophenoxy)acetic Acid; (p-Chlorophenoxy)acetic Acid; (4-Chlorophenoxy)acetic Acid |
IUPAC Name: | 2-(4-chlorophenoxy)acetic acid |
Description: | 2-(4-Chlorophenoxy)acetic Acid is used in the synthesis of a new class of hypoxia-inducible factor-1 inhibitors. |
Molecular Weight: | 186.59 |
Molecular Formula: | C8H7ClO3 |
Canonical SMILES: | C1=CC(=CC=C1OCC(=O)O)Cl |
InChI: | InChI=1S/C8H7ClO3/c9-6-1-3-7(4-2-6)12-5-8(10)11/h1-4H,5H2,(H,10,11) |
InChI Key: | SODPIMGUZLOIPE-UHFFFAOYSA-N |
Melting Point: | 155-160°C |
Solubility: | DMSO (Slightly), Methanol (Slightly) |
Appearance: | White to Off-White Solid |
Storage: | 4°C |
References: | Frank, P.V., et al. J. Chem. Sci., 119, 41 (2007); Belecki, K. et al. Org. Proc. Res. Develop., 11, 754 (2007). |
Stability: | It is stable at elevated temperatures (54 °c) and on exposure to metals, But degrades (30% loss in 24 hours) on exposure to sunlight |
GHS Hazard Statement: | H302: Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P317, P330, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
22608080 | 20120815 | Tomato fruit development in the auxin-resistant dgt mutant is induced by pollination but not by auxin treatment | Journal of plant physiology |
22632051 | 20120612 | Construction and performance characteristics of new ion selective electrodes based on carbon nanotubes for determination of meclofenoxate hydrochloride | Analytica chimica acta |
22500447 | 20111201 | [Determination of seven phenoxyacid herbicides in environmental water by high performance liquid chromatography coupled with three phase hollow fiber liquid phase microextraction] | Se pu = Chinese journal of chromatography |
21168241 | 20110615 | Chlorophenoxyacetic acid and chloropyridylphenylurea accelerate translocation of photoassimilates to parthenocarpic and seeded fruits of muskmelon (Cucumis melo) | Journal of plant physiology |
20842699 | 20110101 | Simultaneous determination of three acidic herbicide residues in food crops using HPLC and confirmation via LC-MS/MS | Biomedical chromatography : BMC |
20830208 | 20100907 | The G215R mutation in the Cl-/H+-antiporter ClC-7 found in ADO II osteopetrosis does not abolish function but causes a severe trafficking defect | PloS one |
19817384 | 20091112 | Phenoxy herbicides and fibrates potently inhibit the human chemosensory receptor subunit T1R3 | Journal of medicinal chemistry |
19465094 | 20090910 | Uptake of phenoxyacetic acid derivatives into Caco-2 cells by the monocarboxylic acid transporters | Toxicology letters |
19172175 | 20090101 | Carcinogenic effects in a phenylketonuria mouse model | PloS one |
19786794 | 20090101 | Plant growth regulator (4-chlorophenoxy acetic acid) increases apoptosis in gonads of rats without changing hormonal levels | Hormone research |
Complexity: | 152 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 186.0083718 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 186.0083718 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 46.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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