1-Methylpyrazole-3-boronic Acid - CAS 869973-96-6
Catalog: |
BB038161 |
Product Name: |
1-Methylpyrazole-3-boronic Acid |
CAS: |
869973-96-6 |
Synonyms: |
(1-methyl-3-pyrazolyl)boronic acid; (1-methylpyrazol-3-yl)boronic acid |
IUPAC Name: | (1-methylpyrazol-3-yl)boronic acid |
Description: | 1-Methylpyrazole-3-boronic Acid (CAS# 869973-96-6) is a useful research chemical compound. |
Molecular Weight: | 125.92 |
Molecular Formula: | C4H7N2O2B |
Canonical SMILES: | B(C1=NN(C=C1)C)(O)O |
InChI: | InChI=1S/C4H7BN2O2/c1-7-3-2-4(6-7)5(8)9/h2-3,8-9H,1H3 |
InChI Key: | WUDMJZRGWGQBQH-UHFFFAOYSA-N |
LogP: | -1.90010 |
Publication Number | Title | Priority Date |
CN-113121528-A | Multi-target inhibition compound, composition, functional molecule and application thereof | 20200115 |
WO-2021113263-A1 | Crf receptor antagonists and methods of use | 20191204 |
KR-20210039968-A | Bicyclic compound and use thereof | 20191002 |
US-2021101892-A1 | Bicyclic compound and use thereof | 20191002 |
WO-2021066578-A1 | Bicyclic compound and use thereof | 20191002 |
Complexity: | 101 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 126.0600576 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 126.0600576 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 58.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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