2-(5H-Chromeno[2,3-b]pyridin-7-yl)propanoic acid

Basic Information

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CAS Number

52549-17-4

Molecular Formula

C15H13NO3

Molecular Weight

255.27 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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

Basic Physical Properties

Melting Point

186-190°C

Boiling Point

465.7°C at 760 mmHg

Density

1.1654 (rough estimate)

Refractive Index

1.5500 (estimate)

SMILES

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CC(C1=CC2=C(C=C1)OC3=C(C2)C=CC=N3)C(=O)O

InChI

InChI=1S/C15H13NO3/c1-9(15(17)18)10-4-5-13-12(7-10)8-11-3-2-6-16-14(11)19-13/h2-7,9H,8H2,1H3,(H,17,18)

InChIKey

TVQZAMVBTVNYLA-UHFFFAOYSA-N

LogP

2.9662000000000006

Topological Polar Surface Area

59.42 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

346

Safety Information

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GHS Hazard Pictograms

H301

Hazard Statement

H301 Toxic if swallowed
Acute toxicity, oral

Hazard Class

Class 6.1 Class 6.1

Toxicity

LD50 in male mice, rats (mg/kg): 447.3, 87.3 orally (Edanaga)

Synonyms & References

English

UNII-2R7O1ET613
DB13514
Pranoprofen [INN:JAN]
D01578
MFCD00866111
SCHEMBL26008
AB01275517-01
2-(5H-[1]Benzopyrano[2,3-b]pyridin-7-yl)propionic acid
NSC-759832
pyranoprofen
(2S)-2-(5H-chromeno[2,3-b]pyridin-7-yl)propanoic acid
alpha-Methyl-5H-(1)benzopyrano(2,3-b)pyridine-7-acetic acid
AKOS015918442
2-(5H-[1]benzopyrano-[2,3-b]pyridin-7-yl)propionic acid
2-{5H-chromeno[2,3-b]pyridin-7-yl}propanoic acid
SR-05000001513-1
NCGC00167980-02
pranoprofen
P2778
Pranoprofeno [INN-Spanish]
AB01275517_02
AB01275517_03
5H-[1]Benzopyrano[2,3-b]pyridine-7-acetic acid, .alpha.-methyl-
BRN 0889798
2R7O1ET613
AS-12631
Tox21_112601_1
CHEBI:32040
PRANOPROFEN [JAN]
Niflan
Tox21_112601

MDL Number

MFCD00866111

Customs Code

2934999090

FAQ

What is 2-(5H-Chromeno[2,3-b]pyridin-7-yl)propanoic acid (CAS: 52549-17-4)?

2-(5H-Chromeno[2,3-b]pyridin-7-yl)propanoic acid is a chemical compound with the CAS number 52549-17-4. It belongs to the class of organic acids and contains a chromeno[2,3-b]pyridine ring fused with a propionic acid group. The compound is known for its potential applications in medicinal chemistry and is often used as a building block in the synthesis of various pharmaceuticals.

What are the main uses of 2-(5H-Chromeno[2,3-b]pyridin-7-yl)propanoic acid (CAS: 52549-17-4)?

2-(5H-Chromeno[2,3-b]pyridin-7-yl)propanoic acid (CAS: 52549-17-4) is primarily used in pharmaceutical research for the development of drugs targeting specific biological pathways. It serves as an intermediate in the synthesis of compounds with potential anti-inflammatory, antimicrobial, and antitumor properties. Additionally, it may find applications in organic synthesis and chemical research due to its structural versatility.

Is 2-(5H-Chromeno[2,3-b]pyridin-7-yl)propanoic acid (CAS: 52549-17-4) safe?

2-(5H-Chromeno[2,3-b]pyridin-7-yl)propanoic acid (CAS: 52549-17-4) is generally considered safe when handled properly in controlled laboratory settings. However, as with many organic compounds, it may cause irritation to the skin, eyes, or respiratory system. Safety precautions include using appropriate personal protective equipment (PPE) and ensuring proper ventilation. Always follow standard chemical safety guidelines and consult safety data sheets (SDS) for detailed information.

How should 2-(5H-Chromeno[2,3-b]pyridin-7-yl)propanoic acid (CAS: 52549-17-4) be stored?

2-(5H-Chromeno[2,3-b]pyridin-7-yl)propanoic acid (CAS: 52549-17-4) should be stored in a cool, dry, and well-ventilated area, away from direct light and moisture. It is typically kept in a sealed container to prevent exposure to air and humidity. Storage conditions should maintain a temperature below 25°C and ensure the compound remains stable under controlled environmental factors.