5-Methoxycarbonyl-2-pyridineboronic Acid Pinacol Ester - CAS 1310384-84-9
Catalog: |
BB007235 |
Product Name: |
5-Methoxycarbonyl-2-pyridineboronic Acid Pinacol Ester |
CAS: |
1310384-84-9 |
Synonyms: |
6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinecarboxylic acid methyl ester; methyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxylate |
IUPAC Name: | methyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxylate |
Description: | 5-Methoxycarbonyl-2-pyridineboronic Acid Pinacol Ester (CAS# 1310384-84-9 ) is a useful research chemical. |
Molecular Weight: | 263.10 |
Molecular Formula: | C13H18NO4B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=NC=C(C=C2)C(=O)OC |
InChI: | InChI=1S/C13H18BNO4/c1-12(2)13(3,4)19-14(18-12)10-7-6-9(8-15-10)11(16)17-5/h6-8H,1-5H3 |
InChI Key: | KFXVZMPKHCLRTO-UHFFFAOYSA-N |
LogP: | 1.16740 |
Publication Number | Title | Priority Date |
CN-108299420-B | Pentacyclic compounds as selective estrogen receptor down-regulators and uses thereof | 20170111 |
Complexity: | 343 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 263.1328882 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 263.1328882 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 57.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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