6-(3-Cyanophenyl)nicotinic acid

Basic Information

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CAS Number

887975-97-5

Molecular Formula

C13H8N2O2

Molecular Weight

213.24 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Nitriles

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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C1=CC(=CC(=C1)C2=NC=C(C=C2)C(=O)O)C#N

InChI

InChI=1S/C13H8N2O2/c14-7-9-2-1-3-10(6-9)12-5-4-11(8-15-12)13(16)17/h1-6,8H,(H,16,17)

InChIKey

GKSSIPVARYBMTM-UHFFFAOYSA-N

LogP

2.7552200000000004

Topological Polar Surface Area

50.19 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

334

Synonyms & References

English

6-(3-Cyanophenyl)nicotinic acid
3-Pyridinecarboxylicacid, 6-(3-cyanophenyl)-
6-(3-CYANOPHENYL)-NICOTINIC ACID
6-(3-cyanophenyl)pyridine-3-carboxylic acid
3-Pyridinecarboxylicacid,6-(3-cyanophenyl)
GKSSIPVARYBMTM-UHFFFAOYSA-N
AB24387
AK128176
AX8249967
6-(3-cyanophenyl)pyridine-3-carboxylic acid, AldrichCPR
6-(3-Cyanophenyl)-3-pyridinecarboxylic acid (ACI)
SCHEMBL2072733
DS-5769
6-(3-Cyanophenyl)-nicotinic acid
6-(3-CYANOPHENYL)PYRIDINE-3-CARBOXYLIC ACID
AKOS016013226
CS-0156934
MFCD06410410
C76979
DB-341571
887975-97-5
6-(3-Cyanophenyl)nicotinicacid
DTXSID70591435

MDL Number

MFCD06410410

FAQ

What is 6-(3-Cyanophenyl)nicotinic acid (CAS: 887975-97-5)?

6-(3-Cyanophenyl)nicotinic acid, also known as 3-cyanophenyl nicotinate, is a derivative of nicotinic acid. It has a molecular formula of C11H9CNO3. This compound exhibits acidic properties and is used in pharmaceutical research and development due to its unique chemical structure.

What are the main uses of 6-(3-Cyanophenyl)nicotinic acid (CAS: 887975-97-5)?

6-(3-Cyanophenyl)nicotinic acid is primarily used in pharmaceutical research as a potential drug candidate for various conditions. It is also utilized in the synthesis of other chemical compounds and in academia for studying organic chemistry and medicinal chemistry.

Is 6-(3-Cyanophenyl)nicotinic acid (CAS: 887975-97-5) safe?

6-(3-Cyanophenyl)nicotinic acid is generally considered safe when handled with appropriate precautions. However, it should be stored and used in a well-ventilated area, away from direct sunlight and heat. Protective gloves and goggles are recommended to prevent skin and eye contact. Avoid contact with combustible materials to prevent fire risks.

How should 6-(3-Cyanophenyl)nicotinic acid (CAS: 887975-97-5) be stored?

6-(3-Cyanophenyl)nicotinic 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 degradation. Proper storage conditions are essential to maintain the compound's stability and prevent chemical reactions that could alter its properties.