3-(Dimethylamino)-4-fluorophenylboronic Acid - CAS 1186215-34-8

Catalog:	BB004156
Product Name:	3-(Dimethylamino)-4-fluorophenylboronic Acid
CAS:	1186215-34-8
Synonyms:	[3-(dimethylamino)-4-fluorophenyl]boronic acid; [3-(dimethylamino)-4-fluorophenyl]boronic acid

Technical Data

Patents

Computed Properties

IUPAC Name:	[3-(dimethylamino)-4-fluorophenyl]boronic acid
Description:	3-(Dimethylamino)-4-fluorophenylboronic Acid (CAS# 1186215-34-8 ) is a useful research chemical.
Molecular Weight:	182.99
Molecular Formula:	C8H11FNO2B
Canonical SMILES:	B(C1=CC(=C(C=C1)F)N(C)C)(O)O
InChI:	InChI=1S/C8H11BFNO2/c1-11(2)8-5-6(9(12)13)3-4-7(8)10/h3-5,12-13H,1-2H3
InChI Key:	WOWLLSRIXGQMSH-UHFFFAOYSA-N
Storage:	Inert atmosphere, 2-8 °C

Publication Number	Title	Priority Date
WO-2020121261-A1	3,3-difluoroallylamines or salts thereof and pharmaceutical compositions comprising the same	20181214
US-2020223827-A1	3,3-difluoroallylamines or salts thereof and pharmaceutical compositions comprising the same	20181214
CN-113330001-A	3, 3-difluoroallylamine or salt thereof and pharmaceutical composition containing same	20181214
EP-3894398-A1	3,3-difluoroallylamines or salts thereof and pharmaceutical compositions comprising the same	20181214
KR-20190110736-A	Novel triazolone derivatives or its salt and pharmaceutical compositions comprising the same	20180321

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Complexity:	168
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	183.0866869
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	183.0866869
Rotatable Bond Count:	2
Topological Polar Surface Area:	43.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0