2-Ethoxypyrimidine-5-boronic Acid Pinacol Ester - CAS 2223035-77-4
Catalog: |
BB017459 |
Product Name: |
2-Ethoxypyrimidine-5-boronic Acid Pinacol Ester |
CAS: |
2223035-77-4 |
Synonyms: |
2-ethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine; 2-ethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine |
IUPAC Name: | 2-ethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine |
Description: | 2-Ethoxypyrimidine-5-boronic Acid Pinacol Ester (CAS# 2223035-77-4) is a useful research chemical. |
Molecular Weight: | 250.10 |
Molecular Formula: | C12H19N2O3B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CN=C(N=C2)OCC |
InChI: | InChI=1S/C12H19BN2O3/c1-6-16-10-14-7-9(8-15-10)13-17-11(2,3)12(4,5)18-13/h7-8H,6H2,1-5H3 |
InChI Key: | LRZCARRDCNWOIO-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
TW-201932447-A | Integrating stress pathway regulator | 20171102 |
BR-112020008841-A2 | modulators of the integrated stress pathway | 20171102 |
KR-20200096918-A | Modulators of the integrated stress pathway | 20171102 |
US-2020361941-A1 | Modulators of the integrated stress pathway | 20171102 |
CN-112189008-A | Modulators of integrated stress pathways | 20171102 |
Complexity: | 275 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 250.1488726 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 250.1488726 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 53.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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