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1-(2-Chlorophenyl)piperazine - ≥98.0%(GC), high purity , CAS No.39512-50-0

COA

Grade & Purity:

≥98%(GC)

Cas Number: 39512-50-0
Molecular Weight: 196.68
MDL number: MFCD00040727
PubChem CID: 415628
PubChem SID: 504758653

In stock

Item Number

C136306

Grouped product items
SKU	Size	Availability	Price
C136306-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$16.90
C136306-5g	5g	2	$64.90
C136306-25g	25g	1	$199.90
C136306-100g	100g	1	$619.90

View related series

Halogenated heterocyclic block (1171) Piperazines (158)

Basic Description

Synonyms	AB00984746-01 \| CAS-39512-50-0 \| AKOS000101285 \| AQ-360/41428845 \| Piperazine, 1-(2-chlorophenyl)- \| J-800353 \| BDBM50001901 \| EN300-33968 \| J-502995 \| Tox21_113875 \| 1-(o-CHLOROPHENYL)PIPERAZINE \| PDSP2_000001 \| FT-0605524 \| D70185 \| SY050593 \| AC-23377
Specifications & Purity	≥98%(GC)
Storage Temp	Argon charged
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	N-arylpiperazines Dialkylarylamines Aniline and substituted anilines Chlorobenzenes Aryl chlorides Dialkylamines Azacyclic compounds Organopnictogen compounds Organochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Phenylpiperazine - N-arylpiperazine - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Chlorobenzene - Halobenzene - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Benzenoid - Tertiary amine - Secondary amine - Secondary aliphatic amine - Azacycle - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - 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

Associated Targets(Human)

ADRB2 Tclin Beta-2 adrenergic receptor (11824 Activities)

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ADRB1 Tclin Beta-1 adrenergic receptor (6630 Activities)

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HTR1A Tclin Serotonin 1a (5-HT1a) receptor (14969 Activities)

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ADRA2A Tclin Alpha-2a adrenergic receptor (9450 Activities)

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DRD2 Tclin Dopamine D2 receptor (23596 Activities)

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DRD1 Tclin Dopamine D1 receptor (9720 Activities)

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HTR1B Tclin Serotonin 1b (5-HT1b) receptor (2801 Activities)

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ADRA1A Tclin Alpha-1a adrenergic receptor (8359 Activities)

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Associated Targets(non-human)

Rattus norvegicus (775804 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Adra1b Adrenergic receptor alpha-1 (5652 Activities)

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Adra2c Adrenergic receptor alpha-2 (3313 Activities)

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Htr2b Serotonin 2 (5-HT2) receptor (2078 Activities)

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Adra1b Adrenergic receptor alpha (950 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Htr1b Serotonin 1 (5-HT1) receptor (408 Activities)

Discover Target: Htr1b

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

Pubchem Sid	504758653
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504758653
IUPAC Name	1-(2-chlorophenyl)piperazine
INCHI	InChI=1S/C10H13ClN2/c11-9-3-1-2-4-10(9)13-7-5-12-6-8-13/h1-4,12H,5-8H2
InChIKey	PWZDJIUQHUGFRJ-UHFFFAOYSA-N
Smiles	C1CN(CCN1)C2=CC=CC=C2Cl
Isomeric SMILES	C1CN(CCN1)C2=CC=CC=C2Cl
Molecular Weight	196.68
Reaxy-Rn	163955
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=163955&ln=

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

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

Analytical Chart:

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8 results found

Lot Number	Certificate Type	Date	Item
I2306843	Certificate of Analysis	Jun 10, 2025	C136306
I2306839	Certificate of Analysis	Jun 10, 2025	C136306
I2306841	Certificate of Analysis	Jun 10, 2025	C136306
L2412707	Certificate of Analysis	Jun 22, 2024	C136306
I2418099	Certificate of Analysis	Aug 25, 2023	C136306
I2306822	Certificate of Analysis	Aug 25, 2023	C136306
I2306836	Certificate of Analysis	Aug 25, 2023	C136306
I2306838	Certificate of Analysis	Aug 25, 2023	C136306

Chemical and Physical Properties

Sensitivity	Air Sensitive
Refractive Index	1.58
Boil Point(°C)	135 °C/5 mmHg
Molecular Weight	196.670 g/mol
XLogP3	2.000
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	196.077 Da
Monoisotopic Mass	196.077 Da
Topological Polar Surface Area	15.300 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	157.000
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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