1-Cyclohexylpyrazole-4-boronic Acid Pinacol Ester - CAS 1175275-00-9
Catalog: |
BB003952 |
Product Name: |
1-Cyclohexylpyrazole-4-boronic Acid Pinacol Ester |
CAS: |
1175275-00-9 |
Synonyms: |
1-cyclohexyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole; 1-cyclohexyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole |
IUPAC Name: | 1-cyclohexyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole |
Description: | 1-Cyclohexylpyrazole-4-boronic Acid Pinacol Ester (CAS# 1175275-00-9 ) is a useful research chemical. |
Molecular Weight: | 276.18 |
Molecular Formula: | C15H25N2O2B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CN(N=C2)C3CCCCC3 |
InChI: | InChI=1S/C15H25BN2O2/c1-14(2)15(3,4)20-16(19-14)12-10-17-18(11-12)13-8-6-5-7-9-13/h10-11,13H,5-9H2,1-4H3 |
InChI Key: | WCTWBVYTYXBCRR-UHFFFAOYSA-N |
Appearance: | Solid |
Storage: | Inert atmosphere, 2-8 °C |
MDL: | MFCD16659787 |
LogP: | 2.68750 |
Publication Number | Title | Priority Date |
TW-202100520-A | Pyrazolyl pyrimidinylamine compounds as cdk2 inhibitors | 20190305 |
US-2021017156-A1 | Pyrazolyl pyrimidinylamine compounds as cdk2 inhibitors | 20190305 |
US-10189845-B2 | 4,6-substituted-pyrazolo[1,5-a]pyrazines as janus kinase inhibitors | 20141205 |
US-2017362240-A1 | 4,6-SUBSTITUTED-PYRAZOLO[1,5-a]PYRAZINES AS JANUS KINASE INHIBITORS | 20141205 |
US-2019177328-A1 | 4,6-SUBSTITUTED-PYRAZOLO[1,5-a]PYRAZINES AS JANUS KINASE INHIBITORS | 20141205 |
Complexity: | 340 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 276.2009082 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 276.2009082 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 36.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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