3-Oxo-1-cyclohexen-1-boronic Acid - CAS 1626344-47-5
Catalog: |
BB011888 |
Product Name: |
3-Oxo-1-cyclohexen-1-boronic Acid |
CAS: |
1626344-47-5 |
Synonyms: |
(3-oxo-1-cyclohexenyl)boronic acid; (3-oxocyclohexen-1-yl)boronic acid |
IUPAC Name: | (3-oxocyclohexen-1-yl)boronic acid |
Description: | 3-Oxo-1-cyclohexen-1-boronic Acid (CAS# 1626344-47-5 ) is a useful research chemical. |
Molecular Weight: | 139.94 |
Molecular Formula: | C6H9O3B |
Canonical SMILES: | B(C1=CC(=O)CCC1)(O)O |
InChI: | InChI=1S/C6H9BO3/c8-6-3-1-2-5(4-6)7(9)10/h4,9-10H,1-3H2 |
InChI Key: | GHOQHNMWHFFTFZ-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
AU-2016281710-A1 | 3-tetrazolyl-benzene-1,2-disulfonamide derivatives as metallo-beta-lactamase inhibitors | 20150626 |
AU-2016281710-B2 | 3-tetrazolyl-benzene-1,2-disulfonamide derivatives as metallo-Beta-lactamase inhibitors | 20150626 |
CA-2990234-A1 | 3-tetrazolyl-benzene-1,2-disulfonamide derivatives as metallo-beta-lactamase inhibitors | 20150626 |
EA-032698-B1 | 3-TETRAZOLYL-BENZENE-1,2-DISULPHONAMIDE DERIVATIVES AS METAL-β-LACTAMASE INHIBITORS | 20150626 |
EP-3313832-A1 | 3-tetrazolyl-benzene-1,2-disulfonamide derivatives as metallo-beta-lactamase inhibitors | 20150626 |
Complexity: | 174 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 140.0644743 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 140.0644743 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 57.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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