3-Hydroxy-3-phenylpropanoic Acid - CAS 3480-87-3
Catalog: |
BB022295 |
Product Name: |
3-Hydroxy-3-phenylpropanoic Acid |
CAS: |
3480-87-3 |
Synonyms: |
3-hydroxy-3-phenylpropanoic acid; 3-hydroxy-3-phenylpropanoic acid |
IUPAC Name: | 3-hydroxy-3-phenylpropanoic acid |
Description: | 3-Hydroxy-3-phenylpropanoic Acid (CAS# 3480-87-3) is a useful research chemical. |
Molecular Weight: | 166.17 |
Molecular Formula: | C9H10O3 |
Canonical SMILES: | C1=CC=C(C=C1)C(CC(=O)O)O |
InChI: | InChI=1S/C9H10O3/c10-8(6-9(11)12)7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12) |
InChI Key: | AYOLELPCNDVZKZ-UHFFFAOYSA-N |
Boiling Point: | 329.4 °C at 760 mmHg |
Density: | 1.262 g/cm3 |
Appearance: | Solid |
MDL: | MFCD00137907 |
LogP: | 1.19470 |
GHS Hazard Statement: | H302 (50%): 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 |
JP-2021138126-A | Multi-layer container, its manufacturing method, and recycled polyester manufacturing method | 20200306 |
WO-2021177126-A1 | Multilayer container, method for manufacturing same, and method for manufacturing reclaimed polyester | 20200306 |
WO-2021170982-A1 | Therapy | 20200225 |
JP-2021127173-A | Multi-layer container, its manufacturing method, and recycled polyester manufacturing method | 20200214 |
WO-2021161844-A1 | Multilayer container, method for manufacturing same, and method for manufacturing reclaimed polyester | 20200214 |
PMID | Publication Date | Title | Journal |
22939267 | 20120915 | Validation of determination of plasma metabolites derived from thyme bioactive compounds by improved liquid chromatography coupled to tandem mass spectrometry | Journal of chromatography. B, Analytical technologies in the biomedical and life sciences |
22589189 | 20120501 | Proteogenomic evidence for β-oxidation of plant-derived 3-phenylpropanoids in 'Aromatoleum aromaticum' EbN1 | Proteomics |
21485746 | 20110101 | The mind-body-microbial continuum | Dialogues in clinical neuroscience |
20087856 | 20100701 | Proanthocyanidin metabolites associated with dietary fibre from in vitro colonic fermentation and proanthocyanidin metabolites in human plasma | Molecular nutrition & food research |
19152477 | 20081201 | Clinical applications of urinary organic acids. Part 2. Dysbiosis markers | Alternative medicine review : a journal of clinical therapeutic |
Complexity: | 150 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 166.062994177 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 166.062994177 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 57.5 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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