DL-p-Hydroxyphenyllactic acid - CAS 306-23-0
Catalog: |
BB020662 |
Product Name: |
DL-p-Hydroxyphenyllactic acid |
CAS: |
306-23-0 |
Synonyms: |
Hydroxyphenyllactic acid; 3-(p-Hydroxyphenyl)lactic Acid; (RS)-3-(4-Hydroxyphenyl)lactic Acid; (±)-3-(4-Hydroxyphenyl)lactic Acid; 2-Hydroxy-3-(p-hydroxyphenyl)propionic Acid; 3-(4-Hydroxyphenyl)-DL-lactic Acid; 3-(4-Hydroxyphenyl)lactic Acid; DL-3-(4-Hydroxyphenyl)lactic Acid; HPLA; NSC 111175; p-Hydroxy-DL-phenyllactic Acid; α,4-Dihydroxybenzenepropanoic Acid; β-(4-Hydroxyphenyl)lactic Acid; β-(p-Hydroxyphenyl)-DL-lactic Acid; β-(p-Hydroxyphenyl)lactic Acid |
Related CAS: | 6482-98-0 (Deleted CAS) 214967-87-0 (Deleted CAS)
|
IUPAC Name: | 2-hydroxy-3-(4-hydroxyphenyl)propanoic acid |
Description: | DL-p-Hydroxyphenyllactic acid is an antifungal metabolite. |
Molecular Weight: | 182.17 |
Molecular Formula: | C9H10O4 |
Canonical SMILES: | C1=CC(=CC=C1CC(C(=O)O)O)O |
InChI: | InChI=1S/C9H10O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8,10-11H,5H2,(H,12,13) |
InChI Key: | JVGVDSSUAVXRDY-UHFFFAOYSA-N |
Boiling Point: | 370.0±35.0°C at 760 mmHg |
Melting Point: | 134-140°C |
Purity: | ≥95% |
Density: | 1.404 g/cm3 |
Solubility: | Soluble in Acetone (Very Slightly), DMSO (Slightly), Methanol (Slightly) |
Appearance: | White to Off-white Solid |
Storage: | Store at 2-8°C, sealed storage, away from moisture and light |
LogP: | 0.38020 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2021188971-A1 | Monoclonal antibody fusions | 20191219 |
WO-2021127547-A2 | Monoclonal antibody fusions | 20191219 |
EP-3835432-A1 | Interleukin-4-induced gene 1 (il4i1) and respective metabolites as biomarkers for cancer | 20191210 |
WO-2021116357-A1 | Interleukin-4-induced gene 1 (il4i1) and respective metabolites as biomarkers for cancer | 20191210 |
WO-2021102356-A1 | Combination therapy of a coenzyme q10 compound and radiation therapy for treatment of glioma | 20191120 |
PMID | Publication Date | Title | Journal |
25343288 | 20140101 | Evaluation of cadmium-induced nephrotoxicity using urinary metabolomic profiles in sprague-dawley male rats | Journal of toxicology and environmental health. Part A |
22309974 | 20120206 | Enumerating metabolic pathways for the production of heterologous target chemicals in chassis organisms | BMC systems biology |
22530437 | 20120101 | Evaluation of food protective property of five natural products using fresh-cut apple slice model | Pakistan journal of biological sciences : PJBS |
23112854 | 20120101 | Metabolic profiling reveals sphingosine-1-phosphate kinase 2 and lyase as key targets of (phyto-) estrogen action in the breast cancer cell line MCF-7 and not in MCF-12A | PloS one |
21951587 | 20111201 | Effect of biosynthetic intermediates and citrate on the phenyllactic and hydroxyphenyllactic acids production by Lactobacillus plantarum CRL 778 | Journal of applied microbiology |
Complexity: | 173 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 182.05790880 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 182.05790880 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 77.8 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.3 |
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