5-(3-methoxy-phenyl)-isoxazole-3-carboxylic acid - CAS 668971-56-0
Catalog: |
BB033126 |
Product Name: |
5-(3-methoxy-phenyl)-isoxazole-3-carboxylic acid |
CAS: |
668971-56-0 |
Synonyms: |
5-(3-methoxyphenyl)-3-isoxazolecarboxylic acid; 5-(3-methoxyphenyl)-1,2-oxazole-3-carboxylic acid |
IUPAC Name: | 5-(3-methoxyphenyl)-1,2-oxazole-3-carboxylic acid |
Description: | 5-(3-methoxy-phenyl)-isoxazole-3-carboxylic acid (CAS# 668971-56-0) is a useful research chemical. |
Molecular Weight: | 219.19 |
Molecular Formula: | C11H9NO4 |
Canonical SMILES: | COC1=CC=CC(=C1)C2=CC(=NO2)C(=O)O |
InChI: | InChI=1S/C11H9NO4/c1-15-8-4-2-3-7(5-8)10-6-9(11(13)14)12-16-10/h2-6H,1H3,(H,13,14) |
InChI Key: | MQNOGHHJKQIZKN-UHFFFAOYSA-N |
Purity: | 95 % |
MDL: | MFCD05238071 |
LogP: | 2.04840 |
Publication Number | Title | Priority Date |
JP-2019201631-A | Synthesis of therapeutic microvesicles and stem cells | 20180126 |
US-2021054344-A1 | Cpc exosomes mirna373 combination therapies | 20180126 |
EP-3215152-A1 | SMALL MOLECULE INHIBITORS OF THE MITOCHONDRIAL PERMEABILITY TRANSITION PORE (mtPTP) | 20141105 |
US-2018282264-A1 | SMALL MOLECULE INHIBITORS OF THE MITOCHONDRIAL PERMEABILITY TRANSITION PORE (mtPTP) | 20141105 |
WO-2016073633-A1 | SMALL MOLECULE INHIBITORS OF THE MITOCHONDRIAL PERMEABILITY TRANSITION PORE (mtPTP) | 20141105 |
Complexity: | 258 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 219.05315777 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 219.05315777 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 72.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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