2-Fluoro-5-methylphenylboronic Acid - CAS 166328-16-1
Catalog: |
BB012268 |
Product Name: |
2-Fluoro-5-methylphenylboronic Acid |
CAS: |
166328-16-1 |
Synonyms: |
(2-fluoro-5-methylphenyl)boronic acid; (2-fluoro-5-methylphenyl)boronic acid |
IUPAC Name: | (2-fluoro-5-methylphenyl)boronic acid |
Description: | 2-Fluoro-5-methylphenylboronic Acid (CAS# 166328-16-1) is a useful research chemical. |
Molecular Weight: | 153.95 |
Molecular Formula: | C7H8FO2B |
Canonical SMILES: | B(C1=C(C=CC(=C1)C)F)(O)O |
InChI: | InChI=1S/C7H8BFO2/c1-5-2-3-7(9)6(4-5)8(10)11/h2-4,10-11H,1H3 |
InChI Key: | ZLODKAZZRDLUKX-UHFFFAOYSA-N |
Boiling Point: | 291.432 °C at 760 mmHg |
Melting Point: | 77-82 °C (lit.) |
Purity: | ≥ 95 % |
Density: | 1.203 g/cm3 |
MDL: | MFCD03428512 |
LogP: | -0.18610 |
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 |
CN-111961073-A | Continuous synthesis method of arylboronic acid | 20200908 |
CN-111440137-A | 3, 4-benzocoumarin derivative and preparation method and application thereof | 20200428 |
WO-2021084498-A1 | Fluorinated quinoline, quinoxaline and benzo[b][1,4]oxazine derivatives as dihydroorotate dehydrogenase (dhodh) inhibitors for the treatment of cancer, autoimmune and inflammatory diseases | 20191101 |
WO-2021032992-A1 | Pharmaceutical compounds | 20190820 |
US-2020308204-A1 | Organic electroluminescent materials and devices | 20190327 |
Complexity: | 132 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 154.0601378 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 154.0601378 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 40.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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