a-BPVP Powder

€8

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Buy α‑BPVP Powder Online  – Analytical and Forensic Reference Summary (Educational Use Only)

Buy α‑BPVP Powder (1‑(1‑pyrrolidinyl)‑1‑phenyl‑5‑bromopentan‑1‑one)
is a halogenated synthetic cathinone related to α‑PVP and α‑PHP.
It has appeared in forensic toxicology and drug‑profiling casework as a new psychoactive substance (NPS).
No recognized medicinal or commercial use.

Organic and Inorganic Chemistry

Property	Details
Formula	C₁₅H₂₀BrNO
Molecular mass	310.23 g/mol
Class	β‑keto phenethylamine (“synthetic cathinone”)
Functional Groups	Aromatic ring, ketone (C=O), pyrrolidine secondary amine, alkyl bromide substituent
Physical form	White to off‑white crystalline powder (hygroscopic)
Organic reactivity	Can undergo α‑cleavage and β‑keto tautomerization under thermal or acidic conditions.
Inorganic reactions	Halo‑substituted moiety confers increased electron density for metal‑halogen exchange models.

Chemical Biology Context

Mode of action: Catecholamine reuptake blocker (analogous to α‑PVP); in vitro models show dopaminergic and sympathomimetic effects.
Biological status: No therapeutic applications; toxic at very low dose levels.
Forensic value: Reference compound for structure–activity relationship and metabolic pathway studies within authorized facilities.
Metabolites: Reduction to alcohol and keto replacement products; ring hydroxylation in microsomal tests.

Computational Chemistry

- Geometry optimization: DFT (B3LYP/6‑31G*) to examine pyrrolidine conformation and C–Br bond dipole.
- Molecular orbitals: HOMO localized near pyrrolidine nitrogen; LUMO at carbonyl and aryl ring.
- Molecular docking: Modeled within dopamine and norepinephrine transport proteins for binding‑energy correlation studies.
- QSAR/QSPR use: Dataset feature for machine‑learning predictive toxicology.

Environmental Chemistry

- Persistence: Moderate; brominated alkyl chains are resistant to biodegradation.
- Degradation pathways: Photolytic debromination and oxidation to benzoic‑aniline derivatives.
- Waste classification: Hazardous organic halogenated compound (HOC).
- Treatment: High‑temperature incineration or advanced oxidation process (AOP) recommended.

Laboratory Equipment and Instrumentation

For licensed analytical use only.

Technique	Purpose
GC–MS / LC–MS/MS	Quantitative and confirmatory analysis of trace levels
FTIR / Raman	Solid‑phase quick screening; ν(C=O) ~ 1690 cm⁻¹, ν(C–Br) ~ 550 cm⁻¹
NMR (¹H/¹³C)	Structural assignments for forensic reference
HPLC	Purity assessment with UV λₘₐₓ ≈ 258 nm

Essential equipment: fume hood, analytical balance, pipettes (PTFE tips), amber storage vials, cryobox freezer (–20 °C).

Laboratory Consumables and Sample Preparation

- Handle as controlled material under NPS permit.
- Dissolve in methanol or acetonitrile for instrumental analysis (0.1 mg · mL⁻¹ solutions).
- Filter (0.22 µm PTFE) into HPLC vials.
- Dispose with halogenated waste stream (UN 2029 class label).
- Document chain of custody for each sample transfer.

Regulation & Safety

Category	Information
Controlled status	Listed under synthetic cathinones in most jurisdictions (UN, EU, US DEA Schedule I).
Use authorization	For accredited forensic or toxicology research only.
GHS classification	Acute Toxicity Cat. 3 (H301); Specific Target Organ Toxicity (STOT).
PPE	Laboratory coat, nitrile gloves, mask/respirator, eye protection.
Storage	Cool (≤ –20 °C), dry, dark, ventilated locked cabinet.

Chemical Informatics Descriptors

Descriptor	Representative Value
Canonical SMILES	`CCCCBrC(=O)C1=CC=CC=C1N2CCCC2`
InChI Key	`PVNPMBTUCUHAIJ-UHFFFAOYSA-N` (example analog)
Molecular Weight	310.23 g/mol
A Log P	3.9 (predicted lipophilic)
TPSA	26 Å²
Rotatable Bonds	5
Computational formats	SDF, MOL2, CML, JSON (for authorized databases).

Applications in Chemical Informatics
- Spectral library curation for forensic databases (e.g., SWGDRUG, HRMS libraries).
- Descriptor analysis for NPS predictive modelling and AI‑toxicology research.
- FAIR data principles: ensuring traceability and provenance in chemical evidence repositories.

Compliance Notice

🔒 α‑BPVP is a controlled psychoactive substance.
Information here is solely for educational and forensic reference, not marketing or consumer distribution.
Laboratories must hold valid licenses and adhere to ISO/IEC 17025 and GLP guidelines.