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1-[3-(trifluoromethyl)phenyl]piperazine

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Identification
Molecular formula
C11H13F3N2
CAS number
17236-55-6
IUPAC name
1-[3-(trifluoromethyl)phenyl]piperazine
State
State

At room temperature, it is typically a solid. However, it can become a liquid at elevated temperatures, given its relatively low melting point.

Melting point (Celsius)
31.00
Melting point (Kelvin)
304.15
Boiling point (Celsius)
293.80
Boiling point (Kelvin)
566.95
General information
Molecular weight
230.23g/mol
Molar mass
230.2330g/mol
Density
1.2720g/cm3
Appearence

1-[3-(Trifluoromethyl)phenyl]piperazine is typically presented as a solid compound. It may appear as a crystalline powder or in aggregate solid form. The exact appearance can vary based on its purity and form.

Comment on solubility

Solubility of 1-[3-(trifluoromethyl)phenyl]piperazine

The solubility characteristics of 1-[3-(trifluoromethyl)phenyl]piperazine (C11H13F3N2) are influenced by its molecular structure and the presence of a trifluoromethyl group, which can have significant effects on solute-solvent interactions.

Key Points on Solubility:

  • Apolar Solvent Compatibility: The presence of the trifluoromethyl group may enhance the compound's solubility in apolar solvents due to the non-polar characteristics that it imparts.
  • Polar Solvent Behavior: Conversely, the amine functional group (piperazine) and the relatively polar phenyl ring could improve solubility in polar solvents such as water, but the overall solubility may still be moderate to low.
  • Hydrogen Bonding: The potential for hydrogen bonding can facilitate solubility in polar solvents, although the trifluoromethyl group may hinder extensive hydrogen bonding.
  • Temperature Influence: Solubility can be temperature-dependent, with increased temperatures potentially enhancing solubility as kinetic energy increases.

Overall, while you may find 1-[3-(trifluoromethyl)phenyl]piperazine somewhat soluble in certain organic solvents, its solubility profile will vary depending on the specific solvent characteristics. Understanding these factors can help in predicting its behavior in various chemical environments.

Interesting facts

Interesting Facts about 1-[3-(Trifluoromethyl)phenyl]piperazine

1-[3-(Trifluoromethyl)phenyl]piperazine is a fascinating chemical compound that belongs to a class of piperazine derivatives. It has garnered significant attention in both academic and industrial applications due to its unique structure and properties. Here are some noteworthy aspects of this compound:

  • Pharmaceutical Relevance: The presence of the trifluoromethyl group in its structure not only influences its physical properties but also enhances its biological activity, making it an important candidate in drug discovery.
  • Structure-Activity Relationship (SAR): Understanding how changes in the structure of 1-[3-(trifluoromethyl)phenyl]piperazine affect its biological properties is crucial. This compound serves as a key model in SAR studies, helping scientists design more effective therapeutic agents.
  • Receptor Interaction: This compound has been investigated for its potential interactions with various receptors, including those related to neurological pathways, highlighting its relevance in the field of neuropharmacology.
  • Fluorine in Medicinal Chemistry: The incorporation of fluorine atoms in drug design is a strategic choice. According to researchers, "Fluorine can enhance metabolic stability and selectivity." This characteristic makes compounds like 1-[3-(trifluoromethyl)phenyl]piperazine valuable in medicine.

The compound demonstrates an intriguing balance between molecular stability and reactivity, making it a compelling subject for further study. Researchers continue to explore its properties and potential applications, as the influence of halogens like fluorine in organic chemistry continues to unveil new possibilities in drug development and synthetic chemistry.

Synonyms
15532-75-9
1-[3-(Trifluoromethyl)phenyl]piperazine
TFMPP
1-(3-(Trifluoromethyl)phenyl)piperazine
1-(3-Trifluoromethylphenyl)piperazine
3-trifluoromethylphenylpiperazine
Legal E [Street Name]
N-(alpha,alpha,alpha-Trifluoro-3-tolyl)piperazine
Piperazine, 1-[3-(trifluoromethyl)phenyl]-
trifluoromethylphenylpiperazine
1-(m-trifluoromethylphenyl)piperazine
Legal X [Street Name]
EINECS 239-574-4
NSC 128882
25R3ONU51C
1-(3-Trifluoromethyl-phenyl)-piperazine
N-(alpha,alpha,alpha-trifluoro-m-tolyl)piperazine
CHEBI:83536
NSC-128882
N-(3-trifluoromethylphenyl)piperazine
1-[3-(trifluoromethyl)phenyl]-piperazine
CHEMBL274866
Piperazine, 1-(3-(trifluoromethyl)phenyl)-
KKIMDKMETPPURN-UHFFFAOYSA-
FLIBANSERIN METABOLITE M30A
J209.034A
Legal E (Street Name)
Legal X (Street Name)
1-(alpha,alpha,alpha-Trifluoro-m-tolyl)piperazine
PIPERAZINE, 1-(.ALPHA.,.ALPHA.,.ALPHA.-TRIFLUORO-M-TOLYL)-
Spectrum_000227
UNII-25R3ONU51C
N-(-(3-Trifluoromethyl)phenyl)piperazine
TFTP
Spectrum2_001573
Spectrum3_000970
Spectrum4_001090
Spectrum5_001131
Biomol-NT_000117
BSPBio_002579
GTPL115
KBioGR_001480
KBioSS_000707
DivK1c_000823
SCHEMBL231692
SPBio_001506
BPBio1_000221
m-trifluoromethylphenylpiperazine
KBio1_000823
KBio2_000707
KBio2_003275
KBio2_005843
KBio3_001799
3-trifluoro methylphenylpiperazine
3-trifluoromethylphenyl piperazine
DTXSID10165876
DBLHGNABGGDRJQ-UHFFFAOYSA-N
NINDS_000823
(3-Trifluoromethylphenyl)piperazine
3-trifluoromethyl phenyl piperazine
(3-Trifluoromethylphenyl) piperazine
m-Trifluorophenylpiperazine (TFMPP)
BBL020111
BDBM50007406
MFCD00005959
NSC128882
STK397247
4-(3-trifluoromethylphenyl)piperazine
AKOS000120334
1-(3-trifluoromethyl-phenyl)piperazine
1-(3-Trifluoromethylphenyl)-piperazine
1-(m-Trifluoromethylphenyl) piperazine
4-(3-trifluoromethyl-phenyl)piperazine
CS-W007879
FT05850
N-(3-trifluoromethylphenyl)-piperazine
IDI1_000823
N-[3-(trifluoromethyl)phenyl]piperazine
UPCMLD0ENAT5654924:001
4-(3-(trifluoromethyl)phenyl)piperazine
4-(3-trifluoromethyl-phenyl)-piperazine
NCGC00163171-01
NCGC00163171-02
1-(3-(trifluoromethyl)phenyl) piperazine
4-(3-trifluoromethyl- phenyl)-piperazine
TS-03280
N-[3-(trifluoromethyl) phenyl]-piperazine
1-[3-(trifluoromethyl)-phenyl]-piperazine
DB-024584
NS00000405
1-(3-Trifluoromethylphenyl)piperazine free base
C22745
1-(3-Trifluoromethyl-phenyl)-piperazine(TFMPP)
AB00053672-06
L001047
N-(alpha, alpha, alphatrifluoro-m-tolyl)piperazine
N-(alpha,alpha,alpha-trifluoro-m-tolyl)-piperazine
Q419405
1-(alpha, alpha, alpha-trifluoro-m-tolyl)piperazine
1-(alpha,alpha,alpha-trifluoro-meta-tolyl)piperazine
N-(alpha, alpha, alpha-trifluoro-m-tolyl)piperazine
BRD-K94887716-001-01-5
BRD-K94887716-003-02-9
N-(alpha, alpha, alpha-trifluoro-m-tolyl)-piperazine
PIPERAZINE, 1-(ALPHA,ALPHA,ALPHA-TRIFLUORO-M-TOLYL)-
1-(alpha,alpha,alpha-Trifluoro-m-tolyl)piperazine, analytical standard, 96%
239-574-4