methyl 4-fluoro-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzoate

Basic Information

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CAS Number

1235865-75-4

Molecular Formula

C15H11FN2O3

Molecular Weight

286.26 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

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

Basic Physical Properties

Boiling Point

444.0±45.0°C at 760 mmHg

SMILES

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COC(=O)c1ccc(cc1Oc2cc3cc[nH]c3nc2)F

InChI

InChI=1S/C15H11FN2O3/c1-20-15(19)12-3-2-10(16)7-13(12)21-11-6-9-4-5-17-14(9)18-8-11/h2-8H,1H3,(H,17,18)

InChIKey

WOXIJNIAUMZYEL-UHFFFAOYSA-N

LogP

3.280900000000001

Topological Polar Surface Area

64.21000000000001 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

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

methyl 2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)-4-fluorobenzoate
Methyl 2-((1H-pyrrolo[2,3-b]pyridin-5-yl)oxy)-4-fluorobenzoate
ABT199 int 2
ABT199 intermediate 3
methyl 4-fluoro-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzoate

MDL Number

MFCD22566214

FAQ

What is methyl 4-fluoro-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzoate (CAS: 1235865-75-4)?

Methyl 4-fluoro-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzoate (CAS: 1235865-75-4) is an organic compound with a complex molecular structure, consisting of a benzoate ester linked to a 1H-pyrrolo[2,3-b]pyridin-5-yloxy group and a fluorine atom. It is used in pharmaceuticals and research for its unique chemical properties.

What are the main uses of methyl 4-fluoro-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzoate (CAS: 1235865-75-4)?

Methyl 4-fluoro-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzoate (CAS: 1235865-75-4) is primarily used in the pharmaceutical industry for developing new drugs and in research laboratories for studying biological activities. It may also be used in organic synthesis as a reagent.

Is methyl 4-fluoro-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzoate (CAS: 1235865-75-4) safe?

While methyl 4-fluoro-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzoate (CAS: 1235865-75-4) is safe for use in research and pharmaceutical applications, it is important to follow safety guidelines. Wear appropriate protective equipment, such as gloves and goggles, when handling the compound. Ensure good ventilation and store it away from heat and direct sunlight.

How should methyl 4-fluoro-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzoate (CAS: 1235865-75-4) be stored?

Methyl 4-fluoro-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzoate (CAS: 1235865-75-4) should be stored in a cool, dry place away from direct sunlight and heat sources. Use a tightly sealed container to prevent moisture and light exposure. Store it at room temperature (15-25°C) and avoid temperatures above 30°C to prevent degradation.