1-Iodoisoquinoline

Basic Information

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CAS Number

19658-77-6

Molecular Formula

C9H6IN

Molecular Weight

255.06 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Physical State

Pale-yellow to Yellow-brown Solid

Melting Point

73.0 to 77.0 deg-C

SMILES

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Ic1nccc2c1cccc2

InChI

InChI=1S/C9H6IN/c10-9-8-4-2-1-3-7(8)5-6-11-9/h1-6H

InChIKey

FDDBUIWRNBGXHB-UHFFFAOYSA-N

LogP

2.8394000000000013

Topological Polar Surface Area

12.89 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

1-Iodoisoquinoline
NULL
1-Iodoisochinolin
1-iodoisoquiniline
1-iodo-isoquinoline
1-iodoisoquinolone
2-iodoisoquinoline
iodoisoquinoline
isoquinoline,1-iodo
1-IODOISOQUINOLINE

MDL Number

MFCD00234494

Customs Code

2933499090

FAQ

What is 1-Iodoisoquinoline (CAS: 19658-77-6)?

1-Iodoisoquinoline (CAS: 19658-77-6) is a heterocyclic compound with the chemical formula C9H7IO. It is a derivative of isoquinoline containing an iodine substituent. This compound is primarily used in organic synthesis and pharmaceutical research for its reactivity and functional group introduction capabilities.

What are the main uses of 1-Iodoisoquinoline (CAS: 19658-77-6)?

1-Iodoisoquinoline (CAS: 19658-77-6) is mainly used in organic synthesis as a functional group introduction reagent. It serves as a precursor in the preparation of various isoquinoline derivatives, which find applications in pharmaceuticals, agrochemicals, and material science.

Is 1-Iodoisoquinoline (CAS: 19658-77-6) safe?

1-Iodoisoquinoline (CAS: 19658-77-6) can be handled safely with appropriate precautions. It is important to wear protective gloves and goggles when handling this reagent due to its potential irritation. Storage in a cool, dry place away from sources of ignition and incompatible materials is recommended.

How should 1-Iodoisoquinoline (CAS: 19658-77-6) be stored?

1-Iodoisoquinoline (CAS: 19658-77-6) should be stored in a cool, dry place with a temperature below 25°C. It should be kept away from moisture and light to prevent degradation. The container should be tightly sealed to maintain its stability and prevent loss of iodine. Storage in a fume hood is advisable due to its volatility and potential for reactive behavior.