2-(1-Piperazinyl)pyridine-5-boronic Acid Pinacol Ester - CAS 871125-86-9
Catalog: |
BB038262 |
Product Name: |
2-(1-Piperazinyl)pyridine-5-boronic Acid Pinacol Ester |
CAS: |
871125-86-9 |
Synonyms: |
1-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazine; 1-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]piperazine |
IUPAC Name: | 1-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]piperazine |
Description: | 2-(1-Piperazinyl)pyridine-5-boronic Acid Pinacol Ester (CAS# 871125-86-9) is a useful research chemical. |
Molecular Weight: | 289.18 |
Molecular Formula: | C15H24N3O2B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2)N3CCNCC3 |
InChI: | InChI=1S/C15H24BN3O2/c1-14(2)15(3,4)21-16(20-14)12-5-6-13(18-11-12)19-9-7-17-8-10-19/h5-6,11,17H,7-10H2,1-4H3 |
InChI Key: | MEHCIETYEUUYGC-UHFFFAOYSA-N |
Boiling Point: | 450.8 °C at 760 mmHg |
Melting Point: | 137-142 °C |
Flash Point: | Not applicable |
Purity: | 97 % |
Density: | 1.11 g/cm3 |
MDL: | MFCD06795677 |
LogP: | 1.18420 |
GHS Hazard Statement: | H315 (97.44%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2021106588-A1 | Bicyclic heterocycles as fgfr inhibitors | 20191014 |
WO-2021076602-A1 | Bicyclic heterocycles as fgfr inhibitors | 20191014 |
CN-113164476-A | Small molecule inhibitor of DYRK1/CLK and application thereof | 20180928 |
WO-2019235579-A1 | Polymeric dye for detection of hydrogen peroxide and structure for hydrogen peroxide detection | 20180607 |
US-2021096081-A1 | Polymer dye for detecting hydrogen peroxide and structure for detecting hydrogen peroxide | 20180607 |
Complexity: | 356 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 289.1961572 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 289.1961572 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 46.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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