3-(Morpholinomethyl)phenylboronic Acid Pinacol Ester
Product Information
Molecular Formula
C17H26NO3B
Molecular Weight
303.20
Description
3-(Morpholinomethyl)phenylboronic Acid Pinacol Ester (CAS# 364794-80-9) is a useful research chemical.
Synonyms
4-[[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]morpholine; 4-[[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]morpholine
IUPAC Name
4-[[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]morpholine
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)CN3CCOCC3
InChI
InChI=1S/C17H26BNO3/c1-16(2)17(3,4)22-18(21-16)15-7-5-6-14(12-15)13-19-8-10-20-11-9-19/h5-7,12H,8-11,13H2,1-4H3
InChI Key
RCGRLLZELIIKDH-UHFFFAOYSA-N
Boiling Point
409.3 °C at 760 mmHg
Melting Point
52-56 °C
Flash Point
230.0 °F
Purity
95 %
Density
1.08 g/cm3
LogP
1.75590
Safety Information
Precautionary Statement
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word
Warning
Computed Properties
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
3
Exact Mass
303.2005739 g/mol
Monoisotopic Mass
303.2005739 g/mol
Topological Polar Surface Area
30.9Ų
Heavy Atom Count
22
Formal Charge
0
Complexity
366
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| WO-2021262684-A1 | METHODS AND COMPOUNDS FOR RESTORING MUTANT p53 FUNCTION | 2020-06-22 |
| EP-3529241-A1 | Piperidine derivatives as inhibitors of ubiquitin specific protease 7 | 2016-10-20 |
| US-2019256518-A1 | Piperidine derivatives as inhibitors of ubiquitin specific protease 7 | 2016-10-20 |
| WO-2018073602-A1 | Piperidine derivatives as inhibitors of ubiquitin specific protease 7 | 2016-10-20 |
| US-10766903-B2 | Piperidine derivatives as inhibitors of ubiquitin specific protease 7 | 2016-10-20 |
| AU-2017346516-B2 | Piperidine derivatives as inhibitors of ubiquitin specific protease 7 | 2016-10-20 |
| WO-2014157382-A1 | Sphingosine kinase inhibitor | 2013-03-29 |
| AU-2013274465-A1 | Pyridinone and pyridazinone derivatives | 2012-06-12 |
| CA-2875016-A1 | Pyridinone and pyridazinone derivatives | 2012-06-12 |
| EP-2858982-A1 | Pyridinone and pyridazinone derivatives | 2012-06-12 |
