2-(Ethylsulfonyl)phenylboronic Acid - CAS 1042443-60-6
Catalog: |
BB001363 |
Product Name: |
2-(Ethylsulfonyl)phenylboronic Acid |
CAS: |
1042443-60-6 |
Synonyms: |
(2-ethylsulfonylphenyl)boronic acid; (2-ethylsulfonylphenyl)boronic acid |
IUPAC Name: | (2-ethylsulfonylphenyl)boronic acid |
Description: | 2-(Ethylsulfonyl)phenylboronic Acid (CAS# 1042443-60-6) is a useful research chemical. |
Molecular Weight: | 214.05 |
Molecular Formula: | C8H11O4SB |
Canonical SMILES: | B(C1=CC=CC=C1S(=O)(=O)CC)(O)O |
InChI: | InChI=1S/C8H11BO4S/c1-2-14(12,13)8-6-4-3-5-7(8)9(10)11/h3-6,10-11H,2H2,1H3 |
InChI Key: | GNCPGKLAKBQXAU-UHFFFAOYSA-N |
Boiling Point: | 468.424 °C at 760 mmHg |
Density: | 1.341 g/cm3 |
Appearance: | Solid |
Storage: | Sealed in dry, 2-8 °C |
LogP: | 0.24080 |
Publication Number | Title | Priority Date |
US-2021115049-A1 | Substituted pyrazolopyrimidines and substituted purines and their use as ubiquitin-specific-processing protease 1 (usp1) inhibitors | 20181220 |
DE-102017005091-A1 | Substituted 3,4-dihydropyrido [2,3-b] pyrazine-2 (1H) -one | 20160530 |
JP-2016056131-A | Method for producing carbon-carbon coupling product using solid catalyst | 20140910 |
AU-2012225805-A1 | MST1 kinase inhibitors and methods of their use | 20110304 |
WO-2012037108-A1 | Aminoquinoline derivatives as antiviral agents | 20100913 |
Complexity: | 270 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 214.0471102 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 214.0471102 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 83 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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