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1-(2,4-difluorophenyl)piperazine - 96%, high purity , CAS No.115761-79-0

COA

Grade & Purity:

≥96%

Cas Number: 115761-79-0
Molecular Weight: 198.2
PubChem CID: 2734637
PubChem SID: 504761173

In stock

Item Number

D179730

Grouped product items
SKU	Size	Availability	Price
D179730-1g	1g	8	$99.90
D179730-5g	5g	3	$328.90
D179730-25g	25g	7	$1,133.90
D179730-100g	100g	6	$3,159.90
D179730-500g	500g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$11,056.90

Basic Description

Synonyms	1-(2,4-difluorophenyl)piperazine \| 115761-79-0 \| Piperazine, 1-(2,4-difluorophenyl)- \| 1-(2,4-Difluorophenyl)-piperazine \| MFCD00082588 \| Difluorophenylpiperazine \| 2,4-difluorophenylpiperazine \| SCHEMBL233938 \| DTXSID40370411 \| CMCSPBOWEYUGHB-UHFFFAOYSA-N \| 1-(2,4-Difluoro-
Specifications & Purity	≥96%
Storage Temp	Room temperature
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 Fluorobenzenes Aryl fluorides Dialkylamines Azacyclic compounds Organopnictogen compounds Organofluorides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Phenylpiperazine - N-arylpiperazine - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Tertiary amine - Secondary aliphatic amine - Secondary amine - Azacycle - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organohalogen compound - Organopnictogen compound - Organic nitrogen 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

Names and Identifiers

Pubchem Sid	504761173
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504761173
IUPAC Name	1-(2,4-difluorophenyl)piperazine
INCHI	InChI=1S/C10H12F2N2/c11-8-1-2-10(9(12)7-8)14-5-3-13-4-6-14/h1-2,7,13H,3-6H2
InChIKey	CMCSPBOWEYUGHB-UHFFFAOYSA-N
Smiles	C1CN(CCN1)C2=C(C=C(C=C2)F)F
Isomeric SMILES	C1CN(CCN1)C2=C(C=C(C=C2)F)F
Molecular Weight	198.2
Reaxy-Rn	8620369
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8620369&ln=

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

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Analytical Chart:

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7 results found

Lot Number	Certificate Type	Date	Item
I2216278	Certificate of Analysis	Jun 10, 2025	D179730
I2216279	Certificate of Analysis	Jun 10, 2025	D179730
I2216275	Certificate of Analysis	Jun 10, 2025	D179730
I2216276	Certificate of Analysis	Jun 10, 2025	D179730
I2216277	Certificate of Analysis	Jun 10, 2025	D179730
G2304502	Certificate of Analysis	Sep 06, 2022	D179730
L2402444	Certificate of Analysis	Sep 06, 2022	D179730

Chemical and Physical Properties

Molecular Weight	198.210 g/mol
XLogP3	1.600
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	198.097 Da
Monoisotopic Mass	198.097 Da
Topological Polar Surface Area	15.300 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	183.000
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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