2-Fluoro-3-Methoxyphenylboronic acid - CAS 352303-67-4
Catalog: |
BB022537 |
Product Name: |
2-Fluoro-3-Methoxyphenylboronic acid |
CAS: |
352303-67-4 |
Synonyms: |
2-fluoro-3-methoxybenzeneboronic acid; Boronic acid, (2-fluoro-3-methoxyphenyl)-; MFCD02094728; 2-fluoro-3-methoxy-phenyl-boronic acid; AK-34813; BC000799 |
IUPAC Name: | (2-fluoro-3-methoxyphenyl)boronic acid |
Description: | 2-Fluoro-3-methoxyphenylboronic acid was used as the reactant to participate in the regional selective suzuki coupling, the preparation of 17 hydroxysteroid dehydrogenase type 1 inhibitors, and the preparation of boron esters. |
Molecular Weight: | 169.95 |
Molecular Formula: | C7H8BFO3 |
Canonical SMILES: | B(C1=C(C(=CC=C1)OC)F)(O)O |
InChI: | InChI=1S/C7H8BFO3/c1-12-6-4-2-3-5(7(6)9)8(10)11/h2-4,10-11H,1H3 |
InChI Key: | JCKZNMSBFBPDPM-UHFFFAOYSA-N |
Boiling Point: | 326.8±52.0 °C (Predicted) |
Melting Point: | 117-122 °C |
Purity: | 98 % (HPLC) |
Density: | 1.260±0.10 g/cm3 (Predicted) |
Solubility: | Slightly soluble in Chloroform (Heated), DMSO, Methanol |
Appearance: | White-like powder |
Storage: | -20 °C |
MDL: | MFCD02094728 |
LogP: | -0.48590 |
GHS Hazard Statement: | H302 (22.22%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P273, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P391, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112763598-A | Method for separating and determining key intermediate and related impurities of oxadegril sodium by HPLC (high Performance liquid chromatography) method | 20201221 |
CN-111763176-A | GnRH receptor antagonist key intermediate and preparation method thereof | 20200710 |
WO-2021211974-A1 | Hsd17b13 inhibitors and uses thereof | 20200418 |
CN-111333587-A | Substituted pyrimidine-2, 4(1H,3H) -dione derivatives and uses thereof | 20200411 |
CN-111675626-A | Ionone alkaloid derivative and medical application thereof | 20200319 |
Complexity: | 145 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 170.0550524 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 170.0550524 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 49.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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