2-Fluoro-4-(methylsulfonyl)phenylboronic Acid - CAS 957060-85-4

Catalog:	BB041812
Product Name:	2-Fluoro-4-(methylsulfonyl)phenylboronic Acid
CAS:	957060-85-4
Synonyms:	(2-fluoro-4-methylsulfonylphenyl)boronic acid; (2-fluoro-4-methylsulfonylphenyl)boronic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	(2-fluoro-4-methylsulfonylphenyl)boronic acid
Description:	2-Fluoro-4-(methylsulfonyl)phenylboronic Acid (CAS# 957060-85-4) is a useful research chemical.
Molecular Weight:	218.01
Molecular Formula:	C7H8FO4SB
Canonical SMILES:	B(C1=C(C=C(C=C1)S(=O)(=O)C)F)(O)O
InChI:	InChI=1S/C7H8BFO4S/c1-14(12,13)5-2-3-6(8(10)11)7(9)4-5/h2-4,10-11H,1H3
InChI Key:	VTSHDQJNJIIHGS-UHFFFAOYSA-N
Boiling Point:	445.9 °C at 760 mmHg
Density:	1.47 g/cm³
MDL:	MFCD09027248
LogP:	-0.01020

Publication Number	Title	Priority Date
US-2020345699-A1	Hiv protease inhibitors	20190417
WO-2020214716-A1	2-imino-5-oxo-imidazolidine inhibitors of hiv protease	20190417
CA-2886139-A1	Comt inhibitors	20121227
EP-2938600-A1	Comt inhibitors	20121227
EP-2938600-B1	Comt inhibitors	20121227

Related Products

Online Inquiry

Name:

* Phone:

* Service & Products of Interested:

Project Description:

* Quantity:

* Email:

* Verification Code:

Customer Support

If the product you need is not in our catalog, please contact us in time to submit your needs. You can help our website get better and better. Why not submit the request today?

Submit Requirement

Customer Centered

Global Delivery

Warehouses in multiple cities to ensure fast delivery

Quality Assurance

Strict process parameter control to ensure product quality

Large Stock

> 20,000 building blocks and intermediates from stock

Process Scale-up

Process scale-up from lab to industrial scale

Flexible Batch Size

Flexible batch size for diverse industrial demands

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
[850623-36-8]
Potassium (4-Cyanophenyl)trifluoroborate
[2247367-07-1]
4,4,4',4',5,5,5',5'-octaethyl-2,2'-bi(1,3,2-dioxaborolane)
[2246646-61-5]
2-(3-((4-Bromo-2-chlorophenoxy)methyl)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
[2246736-67-2]
2-(3-((4-Bromo-2-fluorophenoxy)methyl)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
[2246811-63-0]
2-(3-((4-Chlorobenzyl)oxy)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	287
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	218.0220382
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	218.0220382
Rotatable Bond Count:	2
Topological Polar Surface Area:	83 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0