4-Bromo-2-fluorophenylboronic acid - CAS 216393-64-5

Catalog:	BB017030
Product Name:	4-Bromo-2-fluorophenylboronic acid
CAS:	216393-64-5
Synonyms:	(4-bromo-2-fluorophenyl)boronic acid

Technical Data

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Computed Properties

IUPAC Name:	(4-bromo-2-fluorophenyl)boronic acid
Description:	4-Bromo-2-fluorophenylboronic acid (CAS# 216393-64-5) is a useful research chemical.
Molecular Weight:	218.82
Molecular Formula:	C6H5BBrFO2
Canonical SMILES:	B(C1=C(C=C(C=C1)Br)F)(O)O
InChI:	InChI=1S/C6H5BBrFO2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3,10-11H
InChI Key:	PKZHIIVZRPUZSU-UHFFFAOYSA-N
Boiling Point:	310.6 °C at 760 mmHg
Flash Point:	Not applicable
Purity:	98 %
Density:	1.75 g/cm³
Appearance:	White solid
MDL:	MFCD01318110
LogP:	0.26800

Publication Number	Title	Priority Date
CN-112375002-A	2,4, 7-trisubstituted fluorene compound and electronic device thereof	20210118
CN-112375002-B	2,4, 7-trisubstituted fluorene compound and electronic device thereof	20210118
CN-112341458-A	Electron transport material, organic electroluminescent device and display device	20200929
CN-111440137-A	3, 4-benzocoumarin derivative and preparation method and application thereof	20200428
WO-2020069625-A1	Transcription factor brn2 inhibitory compounds as therapeutics and methods for their use	20181003

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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:	217.955
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	217.955
Rotatable Bond Count:	1
Topological Polar Surface Area:	40.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0