Benzofuran-5-boronic Acid Pinacol Ester - CAS 519054-55-8
Catalog: |
BB027646 |
Product Name: |
Benzofuran-5-boronic Acid Pinacol Ester |
CAS: |
519054-55-8 |
Synonyms: |
2-(5-benzofuranyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; 2-(1-benzofuran-5-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
IUPAC Name: | 2-(1-benzofuran-5-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
Description: | Benzofuran-5-boronic Acid Pinacol Ester (CAS# 519054-55-8) is a useful research chemical. |
Molecular Weight: | 244.09 |
Molecular Formula: | C14H17O3B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)OC=C3 |
InChI: | InChI=1S/C14H17BO3/c1-13(2)14(3,4)18-15(17-13)11-5-6-12-10(9-11)7-8-16-12/h5-9H,1-4H3 |
InChI Key: | ZQCCCOMKYKVFFN-UHFFFAOYSA-N |
Boiling Point: | 340 °C at 760 mmHg |
Density: | 1.1 g/cm3 |
Appearance: | Slolid |
MDL: | MFCD04115374 |
LogP: | 2.73200 |
GHS Hazard Statement: | H315 (100%): 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 |
CN-111978317-A | Imidazopyridine MNK1/MNK2 kinase inhibitor and preparation method and application thereof | 20190522 |
US-2020102303-A1 | Monoacylglycerol Lipase Modulators | 20180928 |
CN-113164459-A | Monoacylglycerol lipase modulators | 20180928 |
AU-2018294557-A1 | Imidazo(1,2-a)pyrazine modulators of the adenosine A2A receptor | 20170630 |
EP-3645536-A1 | Imidazo[1,2-a]pyrazine modulators of the adenosine a2a receptor | 20170630 |
Complexity: | 313 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 244.1270746 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 244.1270746 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 31.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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Boronic Acids and Esters
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