1-Iodoethyl isopropyl carbonate

Basic Information

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CAS Number

84089-73-6

Molecular Formula

C6H11IO3

Molecular Weight

258.05 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Physical Properties

Boiling Point

204.8 °C at 760 mmHg

Density

1.643

Flash Point

204.8 °C at 760 mmHg

Refractive Index

1.5

SMILES

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CC(C)OC(=O)OC(C)I

InChI

InChI=1S/C6H11IO3/c1-4(2)9-6(8)10-5(3)7/h4-5H,1-3H3

InChIKey

XZVBIIRIWFZJOE-UHFFFAOYSA-N

LogP

2.3290000000000006

Topological Polar Surface Area

35.53 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

114

Synonyms & References

English

(RS)-1-iodo-1-(propan-2-yl)oxycarbonyloxyethane
1-(isopropoxycarbonyloxy)ethyl iodide
isopropyl 1-iodoethyl carbonate
1-IODOETHYL ISOPROPYL CARBONATE
XZVBIIRIWFZJOE-UHFFFAOYSA-N
1-(isopropyloxycarbonyloxy)ethyl iodide
SODIUM1-UNDECANESULFONATE
CS-0182735
1-iodoethyl Propan-2-yl Carbonate
84089-73-6
DTXSID60451812
AKOS015963370
SCHEMBL1783323
isopropyl 1-iodoethoxyformate
1-Iodoethyl isopropyl carbonate
1-iodoethyl propan-2-yl carbonate
1-Iodoethyl 1-methylethyl carbonate
Carbonic acid,1-iodoethyl 1-methylethyl ester
iodo-1-isopropoxycarbonyloxyethane
iodoethylisopropyl carbonate
1-(Isopropoxycarbonyloxy)ethyliodide

MDL Number

MFCD09031344

FAQ

What are the physical and chemical properties of 1-Iodoethyl isopropyl carbonate (CAS: 84089-73-6)?

1-Iodoethyl isopropyl carbonate (CAS: 84089-73-6) is a colorless to pale yellow liquid. It has a molecular weight of approximately 270.26 g/mol. The compound is poorly soluble in water but miscible with most organic solvents. It is a reactive compound, showing reactivity towards nucleophiles and bases, making it useful in various organic transformations.

How is 1-Iodoethyl isopropyl carbonate (CAS: 84089-73-6) typically synthesized?

1-Iodoethyl isopropyl carbonate can be synthesized via the reaction of isopropyl isocyanate with iodoethanol in the presence of a base such as potassium carbonate. The reaction yields a high yield of 1-Iodoethyl isopropyl carbonate, often with excellent selectivity. This method is commonly used in organic synthesis for its simplicity and effectiveness.

What industries use 1-Iodoethyl isopropyl carbonate (CAS: 84089-73-6)?

1-Iodoethyl isopropyl carbonate (CAS: 84089-73-6) is primarily used in the pharmaceutical and polymer industries. It serves as a useful reagent in the synthesis of drug intermediates and is also employed as a cross-linking agent in polymer chemistry to improve material properties.

What precautions should be taken when handling 1-Iodoethyl isopropyl carbonate (CAS: 84089-73-6)?

When handling 1-Iodoethyl isopropyl carbonate (CAS: 84089-73-6), it is important to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work in a well-ventilated area or a fume hood to minimize exposure. Spills should be cleaned up using an appropriate absorbent material, and the area should be decontaminated. Always refer to the Safety Data Sheet (SDS) for detailed handling instructions and emergency procedures.