Methyl 2-chlorobenzoate

Basic Information

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CAS Number

610-96-8

Molecular Formula

C8H7ClO2

Molecular Weight

170.59 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

233-235 °C

Boiling Point

230°C

Density

1.191 g/mL at 25 °C

Refractive Index

n20/D 1.536(lit.)

SMILES

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COC(=O)C1=CC=CC=C1Cl

InChI

InChI=1S/C8H7ClO2/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5H,1H3

InChIKey

JAVRNIFMYIJXIE-UHFFFAOYSA-N

LogP

2.1266

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

147

Safety Information

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GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

NSC7320
CAS-610-96-8
Methyl-2-chlorobenzoate
InChI=1/C8H7ClO2/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5H,1H
PS-5049
W-105198
Methyl o-chlorobenzoate
NCGC00256193-01
AKOS008907562
METHYL 2-CHLOROBENZOATE
A833042
EN300-748893
NSC-7320
CHEMBL3188361
NSC 7320
methyl-o-chlorobenzoate
G344NES07R
UNII-G344NES07R
Benzoic acid, o-chloro-, methyl ester
CK2319
610-96-8
2-Chlorobenzoic Acid Methyl Ester
MFCD00016337
2-chloro-benzoic acid methyl ester
CS-B1788
NS00034565
AI3-23031
2-Chlorobenzoic acid, methyl ester
6-Chlorobenzoic acid, methyl ester
Methyl 2-chlorobenzoate, >=98%
SY009666

MDL Number

MFCD00016337

Customs Code

2916399090

FAQ

What regulatory guidelines apply to Methyl 2-chlorobenzoate (CAS: 610-96-8)?

Methyl 2-chlorobenzoate (CAS: 610-96-8) is regulated under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), which includes hazard classification and labeling requirements. It is also subject to the European Union's REACH regulations, which require registration for manufacturers and importers. In the United States, the Environmental Protection Agency (EPA) and the Food and Drug Administration (FDA) have specific requirements for its handling and use, particularly in pesticide and pharmaceutical applications.

Are there alternatives to Methyl 2-chlorobenzoate (CAS: 610-96-8) in synthesis?

There are several alternatives to Methyl 2-chlorobenzoate (CAS: 610-96-8) that can be used in synthesis, depending on the specific needs of the reaction. Common alternatives include 2-chlorobenzoic acid and ethyl 2-chlorobenzoate. These compounds can be used as equivalents in similar reactions, providing similar functional groups for substitution and derivatization.

What is the market or research trend for Methyl 2-chlorobenzoate (CAS: 610-96-8)?

The market for Methyl 2-chlorobenzoate (CAS: 610-96-8) is driven by its application in the pharmaceutical and agrochemical industries, particularly as a precursor in the synthesis of various drugs and pesticides. Recent research trends focus on exploring its use in new drug discovery and the development of more sustainable and environmentally friendly synthesis methods. Market demand is expected to remain steady as these industries continue to require key intermediates for their products.

How should waste containing Methyl 2-chlorobenzoate (CAS: 610-96-8) be handled?

Waste containing Methyl 2-chlorobenzoate (CAS: 610-96-8) should be collected in appropriate containers and stored in a secure area. It should then be disposed of through professional waste disposal services that can handle hazardous waste. Incineration is a common method for disposing of this waste, but it must be conducted in an environmentally friendly manner to minimize emissions. Environmental protection precautions include ensuring proper ventilation and personal protective equipment (PPE) for handlers to prevent exposure to the compound.