2-Chloro-6-fluoro-3-hydroxyphenylboronic Acid - CAS 957121-07-2
Catalog: |
BB041821 |
Product Name: |
2-Chloro-6-fluoro-3-hydroxyphenylboronic Acid |
CAS: |
957121-07-2 |
Synonyms: |
(2-chloro-6-fluoro-3-hydroxyphenyl)boronic acid; (2-chloro-6-fluoro-3-hydroxyphenyl)boronic acid |
IUPAC Name: | (2-chloro-6-fluoro-3-hydroxyphenyl)boronic acid |
Description: | 2-Chloro-6-fluoro-3-hydroxyphenylboronic Acid (CAS# 957121-07-2) is a useful research chemical. |
Molecular Weight: | 190.36 |
Molecular Formula: | C6H5ClFO3B |
Canonical SMILES: | B(C1=C(C=CC(=C1Cl)O)F)(O)O |
InChI: | InChI=1S/C6H5BClFO3/c8-6-4(10)2-1-3(9)5(6)7(11)12/h1-2,10-12H |
InChI Key: | MMQMWHTYNPPUMF-UHFFFAOYSA-N |
Boiling Point: | 378.7 ℃ at 760 mmHg |
Density: | 1.58 g/cm3 |
MDL: | MFCD09800886 |
LogP: | -0.13550 |
Publication Number | Title | Priority Date |
EP-2558577-A1 | Bi-functional complexes and methods for making and using such complexes | 20100416 |
WO-2011127933-A1 | Bi-functional complexes and methods for making and using such complexes | 20100416 |
Complexity: | 160 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 190.00043 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 190.00043 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 60.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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