Description

Isothiocyanic Acid 4-Penten-1-Yl Ester is a specialized organic compound belonging to the class of isothiocyanate esters, which are valuable intermediates in synthetic organic chemistry. This compound matters for its role as a versatile building block, enabling the introduction of the reactive isothiocyanate functional group into larger molecular frameworks. It is primarily needed by research and development chemists in the pharmaceutical and agrochemical industries for applications such as the synthesis of novel heterocycles, bioactive molecules, and polymer modifiers.

Application

• Pharmaceutical Intermediate: Serves as a key precursor in the synthesis of potential drug candidates, particularly those containing thiourea or heterocyclic moieties.
• Agrochemical Synthesis: Used in the research and development of new pesticides, herbicides, and fungicides.
• Chemical Research: Acts as a versatile building block for organic synthesis, including cycloaddition reactions and polymer functionalization.
• Material Science: Employed in the modification of polymers and surfaces to impart specific chemical properties.
• Bioconjugation: Potential use in linking molecules to biological entities due to the reactivity of the isothiocyanate group with amines.

Basic Information

Product Name	Isothiocyanic Acid 4-Penten-1-Yl Ester
CAS No.	18060-79-2
Molecular Formula	C6H9NS
Molecular Weight	127.21 g/mol
Synonyms	4-Pentenyl isothiocyanate; 5-Isothiocyanato-1-pentene; 1-Penten-5-yl isothiocyanate; Allyl isothiocyanate homologue; NSC 163081
EINECS	Contact for details

Quality Control

Our Isothiocyanic Acid 4-Penten-1-Yl Ester is produced and handled under strict quality management protocols. Each batch undergoes rigorous analytical testing to ensure identity, purity, and consistency. A comprehensive Certificate of Analysis (COA) detailing specifications such as assay (by GC or HPLC), identity (by IR and/or NMR), and impurity profile is provided with every shipment to guarantee it meets your research and development requirements.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place. Recommended storage temperature is 2-8°C for long-term stability. Keep away from heat, sparks, and open flame. Due to its light-sensitive nature, containers should be amber glass or opaque.

Specification

Item	Specification
Appearance	Clear, colorless to pale yellow liquid
Identification (IR)	Conforms to structure
Assay (GC)	≥ 95.0%
Purity (HPLC)	≥ 97.0%
Water Content	≤ 0.5%

Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.