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tert-Butyl 2-amino-4-chloropent-4-enoate

CAS 2059937-76-5Formula C9H16ClNO2MW 205.68PubChem 131631993

A functionalized intermediate, tert-Butyl 2-amino-4-chloropent-4-enoate, is a chlorinated amino ester suitable for various synthetic organic chemistry applications. It features a tert-butyl ester, an amino group, and a chloroalkene moiety, making it a versatile building block for complex molecule synthesis.

Loading RDKit molecule structure...
InChIKey: TWYHUMZZFPBLPP-UHFFFAOYSA-NC9H16ClNO2 | MW 205.68

Chemical Identity

Molecular Formula

C9H16ClNO2

Molecular Weight

205.68 g/mol

Exact Mass

205.086956

PubChem CID

131631993

SMILES String

C=C(Cl)CC(N)C(=O)OC(C)(C)C

Names & Synonyms

tert-Butyl2-amino-4-chloropent-4-enoate
External Identifiers
EN300-341320

Catalog Overview

tert-Butyl 2-amino-4-chloropent-4-enoate (CAS 2059937-76-5) is a research-use chemical characterized by its C9H16ClNO2 formula and a molecular weight of 205. 68 g/mol. This compound is a functionalized intermediate, incorporating a tert-butyl ester, a primary amine, and a terminal chloroalkene group. These distinct functionalities allow for diverse chemical transformations, including amidation, ester hydrolysis, and reactions involving the alkene or chlorine atom.

Use Context

  • Research chemical sourcing
  • Custom synthesis and catalog availability review
  • COA, SDS, pricing, and fulfillment workflow
Read more catalog context

tert-Butyl 2-amino-4-chloropent-4-enoate (CAS 2059937-76-5) is a research-use chemical characterized by its C9H16ClNO2 formula and a molecular weight of 205.68 g/mol. This compound is a functionalized intermediate, incorporating a tert-butyl ester, a primary amine, and a terminal chloroalkene group. These distinct functionalities allow for diverse chemical transformations, including amidation, ester hydrolysis, and reactions involving the alkene or chlorine atom. It is primarily utilized in synthetic organic chemistry as a building block for the construction of more complex molecules, particularly in the development of novel pharmaceutical candidates or agrochemicals. Its structure provides opportunities for selective derivatization and incorporation into various scaffolds.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

Colorless liquid

Physical State

Liquid

Melting Point

5.0 °C

Boiling Point

220.0 °C

Density

1.05 g/cm³

Water Solubility

Sparingly soluble

Flash Point

95.0 °C

Applications / Classifications

Research intermediateCustom synthesis building block

Biological Target Reference

No verified biological target assignment. This compound is listed primarily as a research or synthetic intermediate.

Preliminary Safety-Style Reference

Preliminary

Preliminary safety-style information for reference only. Not a supplier SDS.

Handling and Storage
  • Handle tert-Butyl 2-amino-4-chloropent-4-enoate in a well-ventilated fume hood. Wear appropriate personal protective equipment, including safety goggles, gloves, and a lab coat. Avoid inhalation, ingestion, and skin contact. In case of contact, wash thoroughly with water. Store in a cool, dry place, away from incompatible materials. Consult the Safety Data Sheet (SDS) for detailed safety information before use.

Related Products / Graph Discovery

Related products, derivatives, keywords, and application cues for catalog discovery.

Similar products (text references)

2-Amino-2-(3-fluoropropyl)-4-methylhexanoic acidCAS 2059994-27-1
tert-Butyl (R)-(1-fluoro-3-methylbutan-2-yl)carbamateCAS 942275-75-4
tert-Butyl (S)-(1-fluoro-3-methylbutan-2-yl)carbamateCAS 2761418-78-2
(R)-N-Boc-1-fluoro-2-pentanamineCAS 2006287-11-0
(S)-N-Boc-1-fluoro-2-pentanamineCAS 2006287-05-2

Recommended application cues

Research intermediateCustom synthesis building block

Catalog discovery cues, not supplier-verified claims.

Related HS Code / Compliance

HS Code: 292249GHS Pictograms: GHS07Shipment review: Shipment details require review before fulfillment.

Compliance cues are non-linked reference tags and require shipment review.