1-Isopropylpyrazole-5-boronic Acid - CAS 839714-33-9
Catalog: |
BB037116 |
Product Name: |
1-Isopropylpyrazole-5-boronic Acid |
CAS: |
839714-33-9 |
Synonyms: |
(2-propan-2-yl-3-pyrazolyl)boronic acid; (2-propan-2-ylpyrazol-3-yl)boronic acid |
IUPAC Name: | (2-propan-2-ylpyrazol-3-yl)boronic acid |
Description: | 1-Isopropylpyrazole-5-boronic Acid (CAS# 839714-33-9) is a useful research chemical. |
Molecular Weight: | 153.97 |
Molecular Formula: | C6H11N2O2B |
Canonical SMILES: | B(C1=CC=NN1C(C)C)(O)O |
InChI: | InChI=1S/C6H11BN2O2/c1-5(2)9-6(7(10)11)3-4-8-9/h3-5,10-11H,1-2H3 |
InChI Key: | RWQOGZHKBNANKP-UHFFFAOYSA-N |
LogP: | -0.85620 |
Publication Number | Title | Priority Date |
CN-113121528-A | Multi-target inhibition compound, composition, functional molecule and application thereof | 20200115 |
WO-2021074279-A1 | Spiro-fused tricyclic map4k1 inhibitors | 20191016 |
US-2020270244-A1 | Pyrazolopyridines and triazolopyridines as a2a / a2b inhibitors | 20190129 |
WO-2020159905-A1 | Pyrazolopyridines and triazolopyridines as a2a / a2b inhibitors | 20190129 |
TW-202043226-A | Pyrazolopyridines and triazolopyridines as a2a / a2b inhibitors | 20190129 |
Complexity: | 132 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 154.0913578 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 154.0913578 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 58.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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