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3-(4-Chlorophenyl)piperazin-2-one - 98%, high purity , CAS No.86147-28-6

COA

Grade & Purity:

≥98%

Cas Number: 86147-28-6
Molecular Weight: 210.66
PubChem CID: 57287373

In stock

Item Number

C195381

Grouped product items
SKU	Size	Availability	Price	Qty
C195381-50mg	50mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$31.90
C195381-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$131.90

Basic Description

Synonyms	3-(4-Chlorophenyl)piperazin-2-one \| 86147-28-6 \| 3-(4-CHLORO-PHENYL)-PIPERAZIN-2-ONE \| 3-(4-CHLOROPHENYL)-2-PIPERAZINONE \| MFCD07373585 \| SCHEMBL1673497 \| AMY7784 \| DTXSID20720753 \| FGSVIJLVGJOUGJ-UHFFFAOYSA-N \| 1228559-35-0 \| 1228561-73-6 \| BCP26298 \| AKOS011635834 \| AB37464 \| AB37
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	Phenylpiperazines
Alternative Parents	Alpha amino acid amides Chlorobenzenes Aralkylamines Aryl chlorides Secondary carboxylic acid amides Lactams Dialkylamines Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Alpha-amino acid amide - Phenylpiperazine - Alpha-amino acid or derivatives - Aralkylamine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Lactam - Secondary amine - Secondary aliphatic amine - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Amine - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenylpiperazines. These are compounds containing a phenylpiperazine skeleton, which consists of a piperazine bound to a phenyl 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	3-(4-chlorophenyl)piperazin-2-one
INCHI	InChI=1S/C10H11ClN2O/c11-8-3-1-7(2-4-8)9-10(14)13-6-5-12-9/h1-4,9,12H,5-6H2,(H,13,14)
InChIKey	FGSVIJLVGJOUGJ-UHFFFAOYSA-N
Smiles	C1CNC(=O)C(N1)C2=CC=C(C=C2)Cl
Isomeric SMILES	C1CNC(=O)C(N1)C2=CC=C(C=C2)Cl
Molecular Weight	210.66
Reaxy-Rn	884098
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=884098&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	210.660 g/mol
XLogP3	1.200
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	210.056 Da
Monoisotopic Mass	210.056 Da
Topological Polar Surface Area	41.100 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	214.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
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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