3-Methoxy-4-methylphenylboronic Acid - CAS 917757-15-4
Catalog: |
BB040348 |
Product Name: |
3-Methoxy-4-methylphenylboronic Acid |
CAS: |
917757-15-4 |
Synonyms: |
(3-methoxy-4-methylphenyl)boronic acid; (3-methoxy-4-methylphenyl)boronic acid |
IUPAC Name: | (3-methoxy-4-methylphenyl)boronic acid |
Description: | 3-Methoxy-4-methylphenylboronic Acid (CAS# 917757-15-4) is a useful research chemical. |
Molecular Weight: | 165.98 |
Molecular Formula: | C8H11O3B |
Canonical SMILES: | B(C1=CC(=C(C=C1)C)OC)(O)O |
InChI: | InChI=1S/C8H11BO3/c1-6-3-4-7(9(10)11)5-8(6)12-2/h3-5,10-11H,1-2H3 |
InChI Key: | UMGAGEBOUIODFE-UHFFFAOYSA-N |
Boiling Point: | 318.3 °C at 760 mmHg |
Density: | 1.14 g/cm3 |
Appearance: | White to off-white powder |
MDL: | MFCD08274479 |
LogP: | -0.31660 |
Publication Number | Title | Priority Date |
CN-109666044-B | Organophosphorus compound based on [2.2] p-cyclophane alkyl skeleton and intermediate, preparation method and application thereof | 20180704 |
EP-3786156-A1 | 10h-phenothiazine ferroptosis inhibitor and preparation method therefor and application thereof | 20180427 |
AU-2018340505-A1 | Novel heterocyclic compounds as modulators of mGluR7 | 20170926 |
CA-3075954-A1 | Novel heterocyclic compounds as modulators of mglur7 | 20170926 |
CN-111148744-A | Novel heterocyclic compounds as MGLUR7 modulators | 20170926 |
Complexity: | 140 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 166.0801244 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 166.0801244 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 49.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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