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2-Butoxy-5-(trifluoromethyl)pyridine-3-boronic acid - 95%, high purity , CAS No.1218790-64-7

COA

Grade & Purity:

≥95%

Cas Number: 1218790-64-7
Molecular Weight: 263
PubChem CID: 53216368

In stock

Item Number

B180366

Grouped product items
SKU	Size	Availability	Price	Qty
B180366-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$50.90
B180366-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$228.90

Discover 2-Butoxy-5-(trifluoromethyl)pyridine-3-boronic acid by Aladdin Scientific in 95% for only $50.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	1218790-64-7 \| 2-BUTOXY-5-(TRIFLUOROMETHYL)PYRIDINE-3-BORONIC ACID \| (2-Butoxy-5-(trifluoromethyl)pyridin-3-yl)boronic acid \| [2-butoxy-5-(trifluoromethyl)pyridin-3-yl]boronic acid \| (2-Butoxy-5-(trifluoromethyl)-pyridin-3-yl)boronic acid \| ORZGWYBUBBSXCL-UHFFFAOYS
Specifications & Purity	≥95%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic oxygen compounds
  - Class Organooxygen compounds
    - Subclass Ethers

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	Organooxygen compounds
Subclass	Ethers
Intermediate Tree Nodes	Not available
Direct Parent	Alkyl aryl ethers
Alternative Parents	Pyridines and derivatives Heteroaromatic compounds Boronic acids Organic metalloid salts Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organometalloid compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Alkyl aryl ether - Pyridine - Heteroaromatic compound - Boronic acid derivative - Boronic acid - Azacycle - Organoheterocyclic compound - Organic metalloid salt - Organonitrogen compound - Organofluoride - Organic metalloid moeity - Organohalogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Alkyl fluoride - Alkyl halide - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as alkyl aryl ethers. These are organic compounds containing the alkyl aryl ether functional group with the generic formula R-O-R' , where R is an alkyl group and R' is an aryl group.
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	[2-butoxy-5-(trifluoromethyl)pyridin-3-yl]boronic acid
INCHI	InChI=1S/C10H13BF3NO3/c1-2-3-4-18-9-8(11(16)17)5-7(6-15-9)10(12,13)14/h5-6,16-17H,2-4H2,1H3
InChIKey	ORZGWYBUBBSXCL-UHFFFAOYSA-N
Smiles	B(C1=CC(=CN=C1OCCCC)C(F)(F)F)(O)O
Isomeric SMILES	B(C1=CC(=CN=C1OCCCC)C(F)(F)F)(O)O
PubChem CID	53216368
Molecular Weight	263

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	263.020 g/mol
XLogP3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	5
Exact Mass	263.094 Da
Monoisotopic Mass	263.094 Da
Topological Polar Surface Area	62.600 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	253.000
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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