6-Fluoro-5-methyl-3-pyridineboronic Acid - CAS 904326-92-7

Catalog:	BB039855
Product Name:	6-Fluoro-5-methyl-3-pyridineboronic Acid
CAS:	904326-92-7
Synonyms:	(6-fluoro-5-methyl-3-pyridinyl)boronic acid; (6-fluoro-5-methylpyridin-3-yl)boronic acid

Technical Data

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Computed Properties

IUPAC Name:	(6-fluoro-5-methylpyridin-3-yl)boronic acid
Description:	6-Fluoro-5-methyl-3-pyridineboronic Acid (CAS# 904326-92-7) is a useful research chemical.
Molecular Weight:	154.93
Molecular Formula:	C6H7FNO2B
Canonical SMILES:	B(C1=CC(=C(N=C1)F)C)(O)O
InChI:	InChI=1S/C6H7BFNO2/c1-4-2-5(7(10)11)3-9-6(4)8/h2-3,10-11H,1H3
InChI Key:	XCWIMBMPJGQNHG-UHFFFAOYSA-N
Boiling Point:	333.5 °C at 760 mmHg
Density:	1.28 g/cm³
MDL:	MFCD03411562
LogP:	-0.79110

Publication Number	Title	Priority Date
WO-2021011913-A1	Tau-protein targeting compounds and associated methods of use	20190717
TW-202010742-A	Substituted benzofuran, benzopyrrole,benzothiophene, and structurally related complement inhibitors	20180406
US-2019345135-A1	Substituted benzofuran, benzopyrrole, benzothiophene, and structurally related complement inhibitors	20180406
WO-2019195720-A1	Substituted benzofuran, benzopyrrole, benzothiophene, and structurally related complement inhibitors	20180406
AU-2019247471-A1	Substituted benzofuran, benzopyrrole, benzothiophene, and structurally related complement inhibitors	20180406

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GHS Hazard Statement:	H318 (95%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Precautionary Statement:	P280, P305+P351+P338, and P310
Signal Word:	Danger

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 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0