3-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-6-(methylamino)-2,4(1H,3H)-pyrimidinedione

Basic Information

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CAS Number

871700-22-0

Molecular Formula

C14H13FIN3O2

Molecular Weight

401.18 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Boiling Point

459.4±55.0°C at 760 mmHg

SMILES

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O=C1N(C2CC2)C(C=C(NC)N1C3=CC=C(I)C=C3F)=O

InChI

InChI=1S/C14H13FIN3O2/c1-17-12-7-13(20)18(9-3-4-9)14(21)19(12)11-5-2-8(16)6-10(11)15/h2,5-7,9,17H,3-4H2,1H3

InChIKey

MALTZCVPKJAUOE-UHFFFAOYSA-N

LogP

2.1194999999999995

Topological Polar Surface Area

56.03 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

495

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

3-cyclopropyl-1-(2-fluoro-4-iodophenyl)-6-(methylamino)pyrimidine-2,4(1H,3H)-dione
3-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-6-(methylamino)-2,4(1H,3H )-pyrimidinedione
AK162263
3-cyclopropyl-1-(2-fluoro-4-iodophenyl)-6-methylamino-1H-pyrimidine-2,4-dione
C14H13FIN3O2
MALTZCVPKJAUOE-UHFFFAOYSA-N
BCP14458
3236AH
AX8294620
3-cyclopropyl-1-(2-fluoro-4-iodophenyl)-6-(methylamino)pyrimidine-2,4-dione
3-cyclopropyl-1-(2-fluoro-4-iodo phenyl)-6-(methylamino)pyrimidi ne-2,4(1H,3H)-dione

MDL Number

MFCD18207184

FAQ

What is 3-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-6-(methylamino)-2,4(1H,3H)-pyrimidinedione (CAS: 871700-22-0)?

3-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-6-(methylamino)-2,4(1H,3H)-pyrimidinedione is a chemical compound with a unique structure and properties. It is characterized by its cyclopropyl ring and fluoro-iodo aromatic group, which contribute to its stability and reactivity. This compound may have applications in pharmaceuticals and research due to its specific functional groups.

What are the main uses of 3-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-6-(methylamino)-2,4(1H,3H)-pyrimidinedione (CAS: 871700-22-0)?

3-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-6-(methylamino)-2,4(1H,3H)-pyrimidinedione is primarily used in the pharmaceutical industry as a research compound. It may serve as a lead compound for developing new drugs or as a tool in medicinal chemistry. Its unique structure offers potential for further exploration in drug discovery and development.

Is 3-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-6-(methylamino)-2,4(1H,3H)-pyrimidinedione (CAS: 871700-22-0) safe?

The safety of 3-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-6-(methylamino)-2,4(1H,3H)-pyrimidinedione depends on the intended use and exposure conditions. While it is not inherently harmful, precautions must be taken to avoid direct contact with skin and eyes. Proper ventilation and personal protective equipment are recommended. This compound should be handled with care in a laboratory setting.

How should 3-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-6-(methylamino)-2,4(1H,3H)-pyrimidinedione (CAS: 871700-22-0) be stored?

This compound should be stored in a cool, dry place away from direct sunlight and moisture. It is best to keep it in a tightly sealed container to prevent degradation. Temperatures should be maintained below 25°C, and humidity levels should be controlled to minimize the risk of chemical changes. Proper storage conditions are essential to maintain its integrity and effectiveness.