6-Fluoro-2-methyl-3-pyridineboronic Acid - CAS 904326-91-6

Catalog:	BB039854
Product Name:	6-Fluoro-2-methyl-3-pyridineboronic Acid
CAS:	904326-91-6
Synonyms:	(6-fluoro-2-methyl-3-pyridinyl)boronic acid; (6-fluoro-2-methylpyridin-3-yl)boronic acid

Technical Data

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Computed Properties

IUPAC Name:	(6-fluoro-2-methylpyridin-3-yl)boronic acid
Description:	6-Fluoro-2-methyl-3-pyridineboronic Acid (CAS# 904326-91-6) is a useful research chemical.
Molecular Weight:	154.93
Molecular Formula:	C6H7FNO2B
Canonical SMILES:	B(C1=C(N=C(C=C1)F)C)(O)O
InChI:	InChI=1S/C6H7BFNO2/c1-4-5(7(10)11)2-3-6(8)9-4/h2-3,10-11H,1H3
InChI Key:	FILPSSRLYOLUSF-UHFFFAOYSA-N
Boiling Point:	308 °C at 760 mmHg
Density:	1.28 g/cm³
MDL:	MFCD03411561
LogP:	-0.79110

Publication Number	Title	Priority Date
WO-2021026672-A1	Heterocyclic wdr5 inhibitors as anti-cancer compounds	20190809
WO-2021028806-A1	Heterocyclic wdr5 inhibitors as anti-cancer compounds	20190809
US-2020190093-A1	Substituted xanthine derivatives	20181212
WO-2020120450-A1	Substituted xanthine derivatives	20181212
CN-113166151-A	Substituted xanthine derivatives	20181212

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Complexity:	136
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	155.0553868
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	155.0553868
Rotatable Bond Count:	1
Topological Polar Surface Area:	53.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0