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4-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine - 98%, high purity , CAS No.1009033-87-7

COA

Grade & Purity:

≥98%

Cas Number: 1009033-87-7
Molecular Weight: 281.16
MDL number: MFCD12828171
PubChem CID: 58526497
PubChem SID: 488201931

In stock

Item Number

T405030

Grouped product items
SKU	Size	Availability	Price
T405030-250mg	250mg	4	$68.90
T405030-1g	1g	10	$192.90
T405030-5g	5g	1	$686.90

View related series

arylboronic acid (628) Organoboron (685)

Basic Description

Synonyms	SY038098 \| 4-(Pyridin-4-yl)phenylboronic acid, pinacol ester \| T3400 \| 4-(4-Pyridyl)phenylboric Acid Pinacol Ester \| 4,4,5,5-Tetramethyl-2-[4-(4-pyridyl)phenyl]-1,3,2-dioxaborolane \| CS-W000851 \| DTXSID30729358 \| 1009033-87-7 \| MFCD12828171 \| 4-[4-(4,4,5,
Specifications & Purity	≥98%

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Pyridines and derivatives
    - Subclass Phenylpyridines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyridines and derivatives
Subclass	Phenylpyridines
Intermediate Tree Nodes	Not available
Direct Parent	Phenylpyridines
Alternative Parents	Benzene and substituted derivatives Heteroaromatic compounds Dioxaborolanes Boronic acid esters Oxacyclic compounds Organic metalloid salts Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organometalloid compounds Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	4-phenylpyridine - Monocyclic benzene moiety - Benzenoid - Boronic acid ester - 1,3,2-dioxaborolane - Heteroaromatic compound - Boronic acid derivative - Organic metalloid salt - Azacycle - Oxacycle - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic metalloid moeity - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenylpyridines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyridine ring through a CC or CN bond.
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

Pubchem Sid	488201931
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488201931
IUPAC Name	4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine
INCHI	InChI=1S/C17H20BNO2/c1-16(2)17(3,4)21-18(20-16)15-7-5-13(6-8-15)14-9-11-19-12-10-14/h5-12H,1-4H3
InChIKey	PTNMCYWJKRZCDE-UHFFFAOYSA-N
Smiles	B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)C3=CC=NC=C3
Isomeric SMILES	B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)C3=CC=NC=C3
PubChem CID	58526497
Molecular Weight	281.16
Reaxy-Rn	18873102

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

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

Analytical Chart:

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6 results found

Lot Number	Certificate Type	Date	Item
L2209579	Certificate of Analysis	Oct 29, 2022	T405030
C2528041	Certificate of Analysis	Oct 29, 2022	T405030
A2305139	Certificate of Analysis	Oct 29, 2022	T405030
L2209692	Certificate of Analysis	Oct 29, 2022	T405030
L2209687	Certificate of Analysis	Oct 29, 2022	T405030
E2308178	Certificate of Analysis	Oct 29, 2022	T405030

Chemical and Physical Properties

Melt Point(°C)	112 °C
Molecular Weight	281.200 g/mol
XLogP3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	281.159 Da
Monoisotopic Mass	281.159 Da
Topological Polar Surface Area	31.400 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	342.000
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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