1-(Phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid

Basic Information

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CAS Number

189089-90-5

Molecular Formula

C14H10N2O4S

Molecular Weight

302.31 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

Basic Physical Properties

SMILES

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c1ccc(cc1)S(=O)(=O)n2c(cc3c2nccc3)C(=O)O

InChI

InChI=1S/C14H10N2O4S/c17-14(18)12-9-10-5-4-8-15-13(10)16(12)21(19,20)11-6-2-1-3-7-11/h1-9H,(H,17,18)

InChIKey

DUNCEEUEBVPMEV-UHFFFAOYSA-N

LogP

1.9715

Topological Polar Surface Area

89.26 Å²

Hydrogen Bond Donor/Acceptor

1 / 6

Complexity

496

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

H332 Harmful if inhaled
Acute toxicity, inhalation

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

Synonyms & References

English

1-Benzenesulfonyl-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid
1-(Phenylsulphonyl)-7-azaindole-2-carboxylic acid
1-Benzenesulfonyl-1H-pyrrolo-[2,3-b]pyridine-2-carboxylic acid
1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid
1-phenylsulfonyl-pyrrolo[2,3-b]pyridine-2-carboxylic acid
1-(phenylsulfonyl)-7-azaindole-2-carboxylic acid
1H-Pyrrolo[2,3-b]pyridine-2-carboxylic acid, 1-(phenylsulfonyl)-
1-(benzenesulfonyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid
1-(benzenesulfonyl)pyrrolo[2,3-b]pyridine-2-carboxylic acid
Oprea1_626785
DUNCEEUEBVPMEV-UHFFFAOYSA-N
PB15705
AX

MDL Number

MFCD02083337

Customs Code

2933990090

FAQ

What is 1-(Phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid (CAS: 189089-90-5)?

1-(Phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid is a chemical compound with the CAS number 189089-90-5. It is a heterocyclic compound with properties such as solubility in organic solvents and a characteristic molecular structure that includes a pyrrolo[2,3-b]pyridine ring fused to a phenylsulfonyl group and a carboxylic acid group.

What are the main uses of 1-(Phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid (CAS: 189089-90-5)?

1-(Phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid is primarily used as a research tool in pharmaceutical and chemical research due to its specific functional groups. It may also serve as a building block in the synthesis of other compounds.

Is 1-(Phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid (CAS: 189089-90-5) safe?

1-(Phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid is generally safe when handled with appropriate precautions. However, exposure to skin or inhalation can cause irritation. Protective measures such as gloves, safety goggles, and proper ventilation are recommended.

How should 1-(Phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid (CAS: 189089-90-5) be stored?

1-(Phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent moisture and light exposure. The storage temperature should be below 25°C (77°F) to maintain stability.