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1-(2-Chloropyridin-4-yl)piperazine - 98%, high purity , CAS No.854159-45-8

COA

Grade & Purity:

≥98%

Cas Number: 854159-45-8
Molecular Weight: 197.67
PubChem CID: 21274462

In stock

Item Number

C195332

Grouped product items
SKU	Size	Availability	Price	Qty
C195332-50mg	50mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$27.90
C195332-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$114.90

Basic Description

Synonyms	1-(2-Chloropyridin-4-yl)piperazine \| 854159-45-8 \| 1-(2-CHLORO-PYRIDIN-4-YL)-PIPERAZINE \| MFCD06738480 \| SCHEMBL1432978 \| DTXSID80611870 \| 1-(2-Chloro-4-pyridyl)piperazine \| AMY37439 \| CS-B1032 \| AKOS006294864 \| AB27202 \| Piperazine, 1-(2-chloro-4-pyridinyl)- \| DS-10809 \| SY110621
Specifications & Purity	≥98%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Diazinanes
    - Subclass Piperazines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Diazinanes
Subclass	Piperazines
Intermediate Tree Nodes	Not available
Direct Parent	Pyridinylpiperazines
Alternative Parents	N-arylpiperazines Dialkylarylamines Aminopyridines and derivatives 2-halopyridines Aryl chlorides Heteroaromatic compounds Dialkylamines Azacyclic compounds Organopnictogen compounds Organochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	N-arylpiperazine - Pyridinylpiperazine - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Aminopyridine - 2-halopyridine - Aryl chloride - Aryl halide - Pyridine - Heteroaromatic compound - Tertiary amine - Secondary aliphatic amine - Azacycle - Secondary amine - Organochloride - Organohalogen compound - Amine - Hydrocarbon derivative - Organopnictogen compound - Organonitrogen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as pyridinylpiperazines. These are compounds containing a pyridinylpiperazine skeleton, which consists of a pyridine linked (not fused) to a piperazine by a bond by a single bond that is not part of a 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	1-(2-chloropyridin-4-yl)piperazine
INCHI	InChI=1S/C9H12ClN3/c10-9-7-8(1-2-12-9)13-5-3-11-4-6-13/h1-2,7,11H,3-6H2
InChIKey	CVBPSGWUINXSQC-UHFFFAOYSA-N
Smiles	C1CN(CCN1)C2=CC(=NC=C2)Cl
Isomeric SMILES	C1CN(CCN1)C2=CC(=NC=C2)Cl
Molecular Weight	197.67
Reaxy-Rn	9998275
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9998275&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	197.660 g/mol
XLogP3	1.300
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	197.072 Da
Monoisotopic Mass	197.072 Da
Topological Polar Surface Area	28.200 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	159.000
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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