2,5-Difluoro-4-methoxyphenylboronic acid - CAS 897958-93-9

Catalog:	BB039602
Product Name:	2,5-Difluoro-4-methoxyphenylboronic acid
CAS:	897958-93-9
Synonyms:	(2,5-difluoro-4-methoxyphenyl)boronic acid; (2,5-difluoro-4-methoxyphenyl)boronic acid

Technical Data

Patents

Computed Properties

IUPAC Name:	(2,5-difluoro-4-methoxyphenyl)boronic acid
Description:	2,5-Difluoro-4-methoxyphenylboronic acid (CAS# 897958-93-9) is a useful research chemical.
Molecular Weight:	187.94
Molecular Formula:	C7H7BF2O3
Canonical SMILES:	B(C1=CC(=C(C=C1F)OC)F)(O)O
InChI:	InChI=1S/C7H7BF2O3/c1-13-7-3-5(9)4(8(11)12)2-6(7)10/h2-3,11-12H,1H3
InChI Key:	BRMUXDWCSVTVPQ-UHFFFAOYSA-N
Boiling Point:	301.3 °C at 760 mmHg
Purity:	95 %
Density:	1.35 g/cm³
MDL:	MFCD04038754
LogP:	-0.34680

Publication Number	Title	Priority Date
WO-2020126952-A1	Imidazopyrazine derivatives as antibacterial agents	20181217
WO-2020126953-A1	Novel imidazopyrazine derivatives as antibacterials	20181217
WO-2020126954-A1	Novel imidazopyrazine derivatives	20181217
WO-2020126956-A1	Imidazopyrazine derivatives as antibacterial agents	20181217
WO-2020127075-A1	Imidazopyrazine derivatives as antibacterials	20181217

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Related Functional Groups

Boronic Acids and Esters

[2454490-85-6]
2-(7,8-Difluoro-1-naphthyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
[380430-53-5]
2-Ethoxycarbonylphenylboronic Acid
[355836-10-1]
2-Methoxy-4-(trifluoromethoxy)phenylboronic Acid
[937796-06-0]
4-(3,5-Dimethyl-1-pyrazolyl)phenylboronic Acid Pinacol Ester
[1450835-21-8]
(6-Chlorobenzo[b]thiophen-2-yl)boronic acid
[1257724-90-5]
2-(3-Hydroxyphenyl)-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione

Complexity:	170
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	188.0456306
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	188.0456306
Rotatable Bond Count:	2
Topological Polar Surface Area:	49.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0