Quinoxaline-5-boronic Acid - CAS 1310707-17-5

Catalog:	BB007248
Product Name:	Quinoxaline-5-boronic Acid
CAS:	1310707-17-5
Synonyms:	5-quinoxalinylboronic acid; quinoxalin-5-ylboronic acid

Technical Data

Patents

Computed Properties

IUPAC Name:	quinoxalin-5-ylboronic acid
Description:	Quinoxaline-5-boronic Acid (CAS# 1310707-17-5 ) is a useful research chemical.
Molecular Weight:	173.96
Molecular Formula:	C8H7N2O2B
Canonical SMILES:	B(C1=C2C(=CC=C1)N=CC=N2)(O)O
InChI:	InChI=1S/C8H7BN2O2/c12-9(13)6-2-1-3-7-8(6)11-5-4-10-7/h1-5,12-13H
InChI Key:	AZUVFYYLVPQRRL-UHFFFAOYSA-N
LogP:	-0.69040

Publication Number	Title	Priority Date
EP-2968207-A1	Histone deacetylase inhibitors and compositions	20130314
US-10106535-B2	Histone deacetylase inhibitors and compositions and methods of use thereof	20130314
US-2016031876-A1	Histone deacetylase inhibitors and compositions and methods of use thereof	20130314
US-2017305900-A1	Histone deacetylase inhibitors and compositions and methods of use thereof	20130314
US-9617259-B2	Histone deacetylase inhibitors and compositions and methods of use thereof	20130314

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Complexity:	180
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	174.0600576
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	174.0600576
Rotatable Bond Count:	1
Topological Polar Surface Area:	66.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0