5,6,7,8-Tetrahydronaphthalene-2-boronic Acid Pinacol Ester - CAS 627526-54-9
Catalog: |
BB031780 |
Product Name: |
5,6,7,8-Tetrahydronaphthalene-2-boronic Acid Pinacol Ester |
CAS: |
627526-54-9 |
Synonyms: |
4,4,5,5-tetramethyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3,2-dioxaborolane; 4,4,5,5-tetramethyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3,2-dioxaborolane |
IUPAC Name: | 4,4,5,5-tetramethyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3,2-dioxaborolane |
Description: | 5,6,7,8-Tetrahydronaphthalene-2-boronic Acid Pinacol Ester (CAS# 627526-54-9 ) is a useful research chemical. |
Molecular Weight: | 258.16 |
Molecular Formula: | C16H23O2B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(CCCC3)C=C2 |
InChI: | InChI=1S/C16H23BO2/c1-15(2)16(3,4)19-17(18-15)14-10-9-12-7-5-6-8-13(12)11-14/h9-11H,5-8H2,1-4H3 |
InChI Key: | CAEUETONSQGECS-UHFFFAOYSA-N |
LogP: | 2.86460 |
Publication Number | Title | Priority Date |
JP-2019043940-A | Boron diiodide compound, boronic acid and boronic acid ester obtained therefrom, etc., and method for producing them | 20170830 |
KR-20190088404-A | 3- (2,3-dihydro-1H-inden-5-yl) propanoic acid derivatives and their use as NRF2 regulators | 20161206 |
KR-20180018684-A | NRF2 modulator | 20150615 |
US-2014094609-A1 | Process for the preparation of an hiv integrase inhibitor | 20121003 |
US-2014094610-A1 | Process for the preparation of an hiv integrase inhibitor | 20110404 |
Complexity: | 324 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 258.1791101 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 258.1791101 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 18.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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