Phenoxymethylpenicillin EP Impurity B - CAS 122-59-8
Catalog: |
BB005432 |
Product Name: |
Phenoxymethylpenicillin EP Impurity B |
CAS: |
122-59-8 |
Synonyms: |
Phenyl ether glycolic acid; Phenoxy-Acetic Acid; 2-phenoxy-acetic acid; Acide phenoxyacetique [French]; POA |
Related CAS: | 154492-74-7 (Phenoxy Acetic Acid-[d5])
|
IUPAC Name: | 2-phenoxyacetic acid |
Description: | Phenoxymethylpenicillin EP Impurity B is Used as an additive in low oil sludge turbine lubricating oil compound. |
Molecular Weight: | 152.15 |
Molecular Formula: | C8H8O3 |
Canonical SMILES: | C1=CC=C(C=C1)OCC(=O)O |
InChI: | InChI=1S/C8H8O3/c9-8(10)6-11-7-4-2-1-3-5-7/h1-5H,6H2,(H,9,10) |
InChI Key: | LCPDWSOZIOUXRV-UHFFFAOYSA-N |
Boiling Point: | 285.0 °C |
Melting Point: | 98-100 °C |
Flash Point: | 165°C |
Purity: | 98 % |
Density: | 1.214 g/cm3 (Predicted) |
Solubility: | Soluble in Acetonitrile |
Appearance: | White to off-white solid |
Storage: | RT |
MDL: | MFCD00004296 |
LogP: | 1.15000 |
Stability: | Stable. Substances to be avoided include strong bases, strong oxidizing agents. Combustible. |
GHS Hazard Statement: | H302 (96.83%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-11033516-B1 | Combination therapies with disulfiram | 20200918 |
US-2021189018-A1 | Hyaluronic acid derivatives | 20191220 |
WO-2021122272-A1 | Low volatile polyamine salts of anionic pesticides | 20191220 |
WO-2021127375-A1 | Hyaluronic acid derivatives | 20191220 |
US-2021191268-A1 | Resist composition and method of forming resist pattern | 20191218 |
PMID | Publication Date | Title | Journal |
26188115 | 20151101 | Development of a physiologically-based pharmacokinetic model of 2-phenoxyethanol and its metabolite phenoxyacetic acid in rats and humans to address toxicokinetic uncertainty in risk assessment | Regulatory toxicology and pharmacology : RTP |
22867432 | 20120822 | Unconventional titania photocatalysis: direct deployment of carboxylic acids in alkylations and annulations | Journal of the American Chemical Society |
22342144 | 20120315 | Antidotes to anthrax lethal factor intoxication. Part 3: Evaluation of core structures and further modifications to the C2-side chain | Bioorganic & medicinal chemistry letters |
21705463 | 20120101 | Urinary biomarkers of exposure to glycol ethers and chlorinated solvents during pregnancy: determinants of exposure and comparison with indirect methods of exposure assessment | Occupational and environmental medicine |
22448339 | 20120101 | Separation of cis- and trans-Asarone from Acorus tatarinowii by Preparative Gas Chromatography | Journal of analytical methods in chemistry |
Complexity: | 127 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 152.047344113 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 152.047344113 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 46.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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