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4-Butoxy-2,3,5,6-tetrafluorophenylboronic acid - 98%, high purity , CAS No.871126-19-1

COA

Grade & Purity:

≥98%

Cas Number: 871126-19-1
Molecular Weight: 266
PubChem CID: 16218039

In stock

Item Number

B187311

Grouped product items
SKU	Size	Availability	Price	Qty
B187311-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$33.90
B187311-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$152.90

Discover 4-Butoxy-2,3,5,6-tetrafluorophenylboronic acid by Aladdin Scientific in 98% for only $33.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	871126-19-1 \| (4-butoxy-2,3,5,6-tetrafluorophenyl)boronic acid \| 4-Butoxy-2,3,5,6-tetrafluorophenylboronic acid \| 4-Butoxy-2,3,5,6-tetrafluorobenzeneboronic acid \| (4-Butoxy-2,3,5,6-tetrafluorophenyl)boronicacid \| SCHEMBL257750 \| DTXSID90584708 \| MFCD07784382 \| AKOS01583
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Phenol ethers

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Phenol ethers
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Phenol ethers
Alternative Parents	Phenoxy compounds Fluorobenzenes Alkyl aryl ethers Aryl fluorides Boronic acids Organic metalloid salts Organofluorides Organoboron compounds Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Phenoxy compound - Phenol ether - Alkyl aryl ether - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Boronic acid derivative - Boronic acid - Organic metalloid salt - Ether - Organic oxygen compound - Organohalogen compound - Organoboron compound - Organofluoride - Organooxygen compound - Organic salt - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	(4-butoxy-2,3,5,6-tetrafluorophenyl)boronic acid
INCHI	InChI=1S/C10H11BF4O3/c1-2-3-4-18-10-8(14)6(12)5(11(16)17)7(13)9(10)15/h16-17H,2-4H2,1H3
InChIKey	DXYUAQQPCWNJQX-UHFFFAOYSA-N
Smiles	B(C1=C(C(=C(C(=C1F)F)OCCCC)F)F)(O)O
Isomeric SMILES	B(C1=C(C(=C(C(=C1F)F)OCCCC)F)F)(O)O
WGK Germany	3
Molecular Weight	266
Reaxy-Rn	18349840
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=18349840&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	266.000 g/mol
XLogP3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	5
Exact Mass	266.074 Da
Monoisotopic Mass	266.074 Da
Topological Polar Surface Area	49.700 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	243.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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