2-Chloro-4-iodonicotinic acid

Basic Information

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CAS Number

544671-78-5

Molecular Formula

C6H3ClINO2

Molecular Weight

283.45 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

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

162-167 °C

Boiling Point

369.284°C at 760 mmHg

Density

2.194

Flash Point

177.137°C

Refractive Index

1.684

SMILES

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C1=CN=C(C(=C1I)C(=O)O)Cl

InChI

InChI=1S/C6H3ClINO2/c7-5-4(6(10)11)3(8)1-2-9-5/h1-2H,(H,10,11)

InChIKey

XOMBFOCJXYZRSI-UHFFFAOYSA-N

LogP

2.0378

Topological Polar Surface Area

50.19 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

167

Safety Information

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Hazard Statement

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

Hazard Class

Class IRRITANT Class IRRITANT

Sensitiveness

Light Sensitive

Synonyms & References

English

AKOS015849894
SY022678
2-Chloro-4-Iodopyridine-3-Carboxylic Acid
2-Chloro-4-iodonicotinicacid
SCHEMBL1989103
FT-0678257
BP-10903
DTXSID50590320
2-CHLORO-4-IODONICOTINIC ACID
2-Chloro-4-iodo-nicotinic acid
544671-78-5
AS-66056
MFCD05663520
2-chloro-4-iodo-3-pyridinecarboxylic acid
AB21846
A830199
XOMBFOCJXYZRSI-UHFFFAOYSA-N
GEO-02915
3-PYRIDINECARBOXYLIC ACID, 2-CHLORO-4-IODO-
CS-W004021
2-Chloro-4-iodopyridine-3-carboxylic acid, 97%
AC-27980
2-Chloro-4-iodonicotinic acid
2-Chloro-4-iodopyridine-3-carboxylic acid
2-chloro-4-iodopyridine-3-carboxylic acid

MDL Number

MFCD05663520

Customs Code

2933399090

FAQ

What regulatory guidelines apply to 2-Chloro-4-iodonicotinic acid (CAS: 544671-78-5)?

2-Chloro-4-iodonicotinic acid (CAS: 544671-78-5) falls under the scope of the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), requiring proper labeling for hazardous properties. Additionally, under REACH regulations, it may be subject to registration if it is produced or imported in quantities above 1 ton per year. FDA and EPA regulations may also apply for its use in pharmaceuticals and environmental concerns, respectively.

Are there alternatives to 2-Chloro-4-iodonicotinic acid (CAS: 544671-78-5) in synthesis?

While 2-Chloro-4-iodonicotinic acid offers unique properties, alternatives such as 2-Iodo-4-nicotinic acid and its analogs can be used depending on the specific requirements of the synthesis. Commonly, researchers consider reagents like 4-chloro-2-iodonicotinic acid or 2-iodonicotinic acid as viable substitutes.

What is the market or research trend for 2-Chloro-4-iodonicotinic acid (CAS: 544671-78-5)?

The market for 2-Chloro-4-iodonicotinic acid is growing due to its application in pharmaceuticals and organic synthesis. Research trends focus on its use as a precursor for the synthesis of other compounds and its potential as a therapeutic agent. Emerging studies also explore its role in medicinal chemistry and as a reagent for developing new drugs.

How should waste containing 2-Chloro-4-iodonicotinic acid (CAS: 544671-78-5) be handled?

Waste containing 2-Chloro-4-iodonicotinic acid (CAS: 544671-78-5) should be collected in appropriate containers and disposed of according to local waste management guidelines. Professional waste disposal services can handle the incineration or other methods of destruction, ensuring environmental protection. Precautions include proper personal protective equipment and following safety protocols to prevent environmental contamination.