4-(2-Methoxyethyl)phenol - CAS 56718-71-9
Catalog: |
BB029472 |
Product Name: |
4-(2-Methoxyethyl)phenol |
CAS: |
56718-71-9 |
Synonyms: |
Phenol, 4-(2-methoxyethyl)-; Phenol, p-(2-methoxyethyl)-; p-(2-Methoxyethyl)phenol; p-Hydroxyphenethyl methyl ether; Metoprolol Impurity I; Metoprolol Impurity B; Metoprolol EP Impurity B |
IUPAC Name: | 4-(2-methoxyethyl)phenol |
Description: | 4-(2-Methoxyethyl)phenol is an impurity of Metoprolol. |
Molecular Weight: | 152.19 |
Molecular Formula: | C9H12O2 |
Canonical SMILES: | COCCC1=CC=C(C=C1)O |
InChI: | InChI=1S/C9H12O2/c1-11-7-6-8-2-4-9(10)5-3-8/h2-5,10H,6-7H2,1H3 |
InChI Key: | FAYGEALAEQKPDI-UHFFFAOYSA-N |
Boiling Point: | 142°C at 2 Torr |
Melting Point: | 42-43°C |
Purity: | ≥95% |
Density: | 1.060±0.06 g/cm3 |
Solubility: | Soluble in Chloroform (Slightly), Methanol (Slightly) |
Appearance: | White to off-white low melting solid |
Storage: | Store at 2-8°C |
MDL: | MFCD00017537 |
LogP: | 1.58110 |
GHS Hazard Statement: | H315 (96.15%): 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 |
CN-113150287-A | Preparation method of cross-linkable fluorine-containing polyphosphazene | 20210421 |
CN-112645827-A | Method for continuously synthesizing metoprolol and salt thereof | 20201225 |
CN-111620782-A | Preparation method of esmolol hydrochloride intermediate | 20200515 |
CN-111517967-A | Method for synthesizing metoprolol succinate isomer impurity | 20200514 |
JP-2021154560-A | Thermal discoloration writing tool | 20200326 |
PMID | Publication Date | Title | Journal |
21288029 | 20110224 | Mineralization of metoprolol by electro-Fenton and photoelectro-Fenton processes | The journal of physical chemistry. A |
20456957 | 20100515 | Serotonin derivatives as a new class of non-ATP-competitive receptor tyrosine kinase inhibitors | Bioorganic & medicinal chemistry |
Complexity: | 95.7 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 152.083729621 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 152.083729621 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 29.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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