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4-Chloro-3-(piperidine-1-carbonyl)phenylboronic acid - 97%, high purity , CAS No.871332-70-6

COA

Grade & Purity:

≥97%

Cas Number: 871332-70-6
Molecular Weight: 267.5
PubChem CID: 44886933

In stock

Item Number

C187357

Grouped product items
SKU	Size	Availability	Price
C187357-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$36.90
C187357-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$96.90
C187357-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$291.90

Discover 4-Chloro-3-(piperidine-1-carbonyl)phenylboronic acid by Aladdin Scientific in 97% for only $36.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	871332-70-6 \| 4-Chloro-3-(piperidine-1-carbonyl)phenylboronic acid \| (4-Chloro-3-(piperidine-1-carbonyl)phenyl)boronic acid \| [4-chloro-3-(piperidine-1-carbonyl)phenyl]boronic acid \| (4-Chloro-3-(piperidine-1-carbonyl)-phenyl)boronic acid \| DTXSID50661221 \| MFCD07783
Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Benzoyl derivatives

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzoyl derivatives
Intermediate Tree Nodes	Not available
Direct Parent	1-benzoylpiperidines
Alternative Parents	N-benzoylpiperidines 2-halobenzoic acids and derivatives Benzamides Chlorobenzenes Aryl chlorides Tertiary carboxylic acid amides Vinylogous halides Boronic acids Amino acids and derivatives Tertiary amines Organic metalloid salts Azacyclic compounds Organooxygen compounds Organometalloid compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	1-benzoylpiperidine - N-benzoylpiperidine - Halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - N-acyl-piperidine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Piperidine - Vinylogous halide - Tertiary carboxylic acid amide - Amino acid or derivatives - Boronic acid derivative - Boronic acid - Carboxamide group - Tertiary amine - Organoheterocyclic compound - Organic metalloid salt - Azacycle - Carboxylic acid derivative - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organic metalloid moeity - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as 1-benzoylpiperidines. These are compounds containing a piperidine ring substituted at the 1-position with a benzoyl 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	[4-chloro-3-(piperidine-1-carbonyl)phenyl]boronic acid
INCHI	InChI=1S/C12H15BClNO3/c14-11-5-4-9(13(17)18)8-10(11)12(16)15-6-2-1-3-7-15/h4-5,8,17-18H,1-3,6-7H2
InChIKey	QNOMMSMMADZNCM-UHFFFAOYSA-N
Smiles	B(C1=CC(=C(C=C1)Cl)C(=O)N2CCCCC2)(O)O
Isomeric SMILES	B(C1=CC(=C(C=C1)Cl)C(=O)N2CCCCC2)(O)O
PubChem CID	44886933
Molecular Weight	267.5

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	267.520 g/mol
XLogP3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	267.083 Da
Monoisotopic Mass	267.083 Da
Topological Polar Surface Area	60.800 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	297.000
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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