2-Cyanopyridine-3-boronic Acid - CAS 874290-88-7
Catalog: |
BB038449 |
Product Name: |
2-Cyanopyridine-3-boronic Acid |
CAS: |
874290-88-7 |
Synonyms: |
(2-cyano-3-pyridinyl)boronic acid; (2-cyanopyridin-3-yl)boronic acid |
IUPAC Name: | (2-cyanopyridin-3-yl)boronic acid |
Description: | 2-Cyanopyridine-3-boronic Acid (CAS# 874290-88-7) is a useful research chemical. |
Molecular Weight: | 147.93 |
Molecular Formula: | C6H5N2O2B |
Canonical SMILES: | B(C1=C(N=CC=C1)C#N)(O)O |
InChI: | InChI=1S/C6H5BN2O2/c8-4-6-5(7(10)11)2-1-3-9-6/h1-3,10-11H |
InChI Key: | CXEXJQAXEPPQHH-UHFFFAOYSA-N |
Boiling Point: | 433.8 °C at 760 mmHg |
Density: | 1.34 g/cm3 |
MDL: | MFCD08458475 |
LogP: | -1.36692 |
Publication Number | Title | Priority Date |
EP-3666767-A1 | Pyridazinone compound, method for preparation thereof, pharmaceutical composition thereof, and use thereof | 20170810 |
US-2020181109-A1 | Phthalazinone compound, method for preparation thereof, pharmaceutical composition thereof, and use thereof | 20170810 |
US-11040952-B2 | Phthalazinone compound, method for preparation thereof, pharmaceutical composition thereof, and use thereof | 20170810 |
TW-201920165-A | Nitrogen-based compound as a histone methyltransferase inhibitor | 20170609 |
AU-2017263283-A1 | Modulators of indoleamine 2,3-dioxygenase | 20160512 |
Complexity: | 177 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 148.0444076 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 148.0444076 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 77.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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