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1-[4-(Trifluoromethyl)-2-pyrimidinyl]piperazine - ≥97%, high purity , CAS No.179756-91-3

COA

Grade & Purity:

≥97%

Cas Number: 179756-91-3
Molecular Weight: 232.21
PubChem CID: 2778334
PubChem SID: 504762007

In stock

Item Number

T138392

Grouped product items
SKU	Size	Availability	Price
T138392-250mg	250mg	2	$32.90
T138392-1g	1g	3	$66.90
T138392-5g	5g	3	$258.90

Basic Description

Synonyms	179756-91-3 \| 2-(piperazin-1-yl)-4-(trifluoromethyl)pyrimidine \| 1-(4-Trifluoromethylpyrimidin-2-yl)piperazine \| 2-piperazin-1-yl-4-(trifluoromethyl)pyrimidine \| 2-Piperazin-yl-4-(trifluoromethyl)pyrimidine \| 1-[4-(Trifluoromethyl)pyrimid-2-yl]piperazine \| Pyrimidine
Specifications & Purity	≥97%
Storage Temp	Store at 2-8°C,Protected from light,Argon charged
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

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	N-arylpiperazines
Alternative Parents	Dialkylarylamines Aminopyrimidines and derivatives Heteroaromatic compounds Dialkylamines Azacyclic compounds Organopnictogen compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	N-arylpiperazine - Dialkylarylamine - Aminopyrimidine - Pyrimidine - Heteroaromatic compound - Secondary aliphatic amine - Secondary amine - Azacycle - Organopnictogen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl fluoride - Organic nitrogen compound - Alkyl halide - Hydrocarbon derivative - Amine - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as n-arylpiperazines. These are organic compounds containing a piperazine ring where the nitrogen ring atom carries an aryl 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

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	504762007
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504762007
IUPAC Name	2-piperazin-1-yl-4-(trifluoromethyl)pyrimidine
INCHI	InChI=1S/C9H11F3N4/c10-9(11,12)7-1-2-14-8(15-7)16-5-3-13-4-6-16/h1-2,13H,3-6H2
InChIKey	WBJVPAABGFBMJQ-UHFFFAOYSA-N
Smiles	C1CN(CCN1)C2=NC=CC(=N2)C(F)(F)F
Isomeric SMILES	C1CN(CCN1)C2=NC=CC(=N2)C(F)(F)F
PubChem CID	2778334
Molecular Weight	232.21

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

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

Analytical Chart:

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5 results found

Lot Number	Certificate Type	Date	Item
C2528098	Certificate of Analysis	Apr 09, 2025	T138392
B2306313	Certificate of Analysis	Nov 08, 2024	T138392
B2306315	Certificate of Analysis	Nov 08, 2024	T138392
B2306317	Certificate of Analysis	Nov 04, 2024	T138392
B2306669	Certificate of Analysis	Dec 05, 2022	T138392

Chemical and Physical Properties

Sensitivity	Light sensitive
Molecular Weight	232.210 g/mol
XLogP3	0.900
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	1
Exact Mass	232.094 Da
Monoisotopic Mass	232.094 Da
Topological Polar Surface Area	41.100 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	227.000
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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