2-Chloro-5-(trifluoromethyl)isonicotinic acid

Basic Information

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CAS Number

505084-58-2

Molecular Formula

C7H3ClF3NO2

Molecular Weight

225.55 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 Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

185-186°C

Boiling Point

281.6°C at 760 mmHg

Water Solubility

Slightly soluble in water.

Flash Point

124.151℃

SMILES

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C1=C(C(=CN=C1Cl)C(F)(F)F)C(=O)O

InChI

InChI=1S/C7H3ClF3NO2/c8-5-1-3(6(13)14)4(2-12-5)7(9,10)11/h1-2H,(H,13,14)

InChIKey

OIODRBHIESSYRO-UHFFFAOYSA-N

LogP

2.452

Topological Polar Surface Area

50.19 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

234

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

Synonyms & References

English

SY018001
EN300-211758
2-chloro-5-(trifluoromethyl)pyridine-4-carboxylicacid
2-CHLORO-5-(TRIFLUOROMETHYL)ISONICOTINIC ACID
2-Chloro-5-(trifluoromethyl)-pyridine-4-carboxylic acid
Z1269195671
2-chloro-5-(trifluoromethyl)pyridine-4-carboxylic Acid
BL000198
FT-0649992
2-chloro-5-(trifluoromethyl)isonicotinic acid, AldrichCPR
BCP11667
505084-58-2
SCHEMBL474036
PS-6907
AM20061265
2-chloro-5-trifluoromethyl isonicotinic acid
2-chloro-5-(trifluoromethyl)-4-Pyridinecarboxylic acid
2-Chloro-5-(trifluoromethyl)isonicotinic acid 97%
AKOS007930903
AC-25221
CS-W005796
MFCD01862019
DTXSID80460522
A828143
4-PYRIDINECARBOXYLIC ACID, 2-CHLORO-5-(TRIFLUOROMETHYL)-
J-508800
2-Chloro-5-(trifluoromethyl)pyridine-4-carboxylic acid
2-Chloro-5-(trifluoromethyl)isonicotinic acid
4-Pyridinecarboxylic acid, 2-chloro-5-(trifluoromethyl)-
2-chloro-5-(trifluoromethyl)pyridine-4-carboxylic acid

MDL Number

MFCD01862019

Customs Code

2933399090

FAQ

What regulatory guidelines apply to 2-Chloro-5-(trifluoromethyl)isonicotinic acid (CAS: 505084-58-2)?

2-Chloro-5-(trifluoromethyl)isonicotinic acid falls under the classification of hazardous chemicals according to GHS. It is subject to regulatory requirements under REACH in the EU, which includes notification and registration of substances. In the US, it must comply with FDA regulations for pharmaceuticals and EPA guidelines for environmental protection and handling. Special attention should be given to its classification as a hazardous substance due to its chemical properties.

Are there alternatives to 2-Chloro-5-(trifluoromethyl)isonicotinic acid (CAS: 505084-58-2) in synthesis?

Alternatives to 2-Chloro-5-(trifluoromethyl)isonicotinic acid include other isonicotinic acid derivatives such as 3-chloroisonicotinic acid or isonicotinamide. In some cases, synthetic analogs like 2-(trifluoromethyl)isonicotinic acid can be used. These alternatives offer similar functionalities but with varying substitution patterns, which might be more or less suitable depending on the specific application.

What is the market or research trend for 2-Chloro-5-(trifluoromethyl)isonicotinic acid (CAS: 505084-58-2)?

The market for 2-Chloro-5-(trifluoromethyl)isonicotinic acid is driven by its applications in pharmaceuticals and agrochemicals. Recent research trends focus on its use in developing new pharmaceutical compounds and as an intermediate in pesticide synthesis. The trend indicates increasing investment in R&D for novel derivatives and formulations, driven by the need for more effective and safer products.

How should waste containing 2-Chloro-5-(trifluoromethyl)isonicotinic acid (CAS: 505084-58-2) be handled?

Waste containing 2-Chloro-5-(trifluoromethyl)isonicotinic acid should be collected in appropriate containers and disposed of through a licensed hazardous waste management facility. Incineration is a common method, provided it is conducted under controlled conditions to prevent the release of harmful emissions. Environmental precautions include the use of protective clothing and equipment, and adherence to local and international regulations to minimize environmental impact.