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tert-butyl N-(2-chloropropyl)carbamate

CAS 272791-90-9Formula C8H16ClNO2MW 193.67PubChem 45091868

A carbamate derivative featuring a tert-butyl ester and a 2-chloropropyl group, primarily used as a functionalized intermediate in organic synthesis for research purposes.

Loading RDKit molecule structure...
InChIKey: BBAFVRDQRAEQAF-UHFFFAOYSA-NC8H16ClNO2 | MW 193.67

Chemical Identity

Molecular Formula

C8H16ClNO2

Molecular Weight

193.67 g/mol

Exact Mass

193.086956

PubChem CID

45091868

SMILES String

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

Names & Synonyms

990-554-8Carbamic acid, (2-chloropropyl)-, 1,1-dimethylethyl ester (9CI)2-Methyl-2-propanyl (2-chloropropyl)carbamatetert-butylN-(2-chloropropyl)carbamate
External Identifiers
RefChem:895684XKA79190AKOS018380897DB-240280EN300-140473

Catalog Overview

tert-Butyl N-(2-chloropropyl)carbamate, identified by CAS 272791-90-9, is an organic compound with the molecular formula C8H16ClNO2 and a molecular weight of 193.67 g/mol. It is characterized by a carbamate functional group, where the nitrogen is substituted with a 2-chloropropyl chain and the oxygen is esterified with a tert-butyl group. This compound serves as a versatile functionalized intermediate in various synthetic organic chemistry applications, particularly in the construction of more complex molecules. Its chloro- and carbamate functionalities allow for diverse chemical transformations in research settings.

Use Context

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

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

Colorless liquid

Physical State

Liquid

Melting Point

-10.0 °C

Boiling Point

235.0 °C

Density

1.05 g/cm³

Water Solubility

Slightly soluble

Flash Point

105.0 °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 with appropriate personal protective equipment, including gloves, eye protection, and a lab coat. Use in a well-ventilated area or under a fume hood to avoid inhalation. Avoid contact with skin and eyes. In case of contact, rinse thoroughly with water. Store in a cool, dry place, away from incompatible materials. Refer to the Safety Data Sheet (SDS) for comprehensive safety information.

Related Products / Graph Discovery

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

Similar products (text references)

tert-Butyl N-(2-chloroethyl)-N-methylcarbamateCAS 220074-38-4
tert-butyl N-(1-chloropropan-2-yl)carbamateCAS 1520753-28-9
34337-03-6CAS 34337-03-6
2279-16-5CAS 2279-16-5
4090-17-9CAS 4090-17-9

Recommended application cues

Research intermediateCustom synthesis building block

Catalog discovery cues, not supplier-verified claims.

Related HS Code / Compliance

HS Code: 292419GHS Pictograms: GHS07Shipment review: Shipment details require review before fulfillment.

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