Methyl 4,6-dichloronicotinate

Basic Information

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CAS Number

65973-52-6

Molecular Formula

C7H5Cl2NO2

Molecular Weight

206.03 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

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

Physical State

Pale-yellow to Yellow-brown Solid

Melting Point

43-47°C

Boiling Point

260℃ at 760 mmHg

Flash Point

111.1℃

SMILES

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COC(=O)C1=CN=C(C=C1Cl)Cl

InChI

InChI=1S/C7H5Cl2NO2/c1-12-7(11)4-3-10-6(9)2-5(4)8/h2-3H,1H3

InChIKey

JEJMDUMJSZTJTI-UHFFFAOYSA-N

LogP

2.175

Topological Polar Surface Area

39.19 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

177

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

Synonyms & References

English

methyl-4,6-dichloronicotinate
BCP05778
4,6-Dichloronicotinic acid methyl ester
F8889-5803
DTXSID30377292
CS-W003200
EN300-112108
4,6-Dichloro-nicotinic acid methyl
M2641
MFCD04125732
JEJMDUMJSZTJTI-UHFFFAOYSA-N
AM20061419
3-PYRIDINECARBOXYLIC ACID, 4,6-DICHLORO-, METHYL ESTER
5X-0801
BB 0260261
65973-52-6
CL0171
A8921
SCHEMBL474122
SY007499
4,6-dichloro-3-pyridinecarboxylic acid, methyl ester
AC-325
Methyl4,6-dichloronicotinate
PB23404
Methyl 4,6-dichloro nicotinate
Methyl 4,6-dichloronicotinate, AldrichCPR
HMS1368O15
4,6-Dichloro-nicotinic acid methyl ester
Bionet2_001679
Z1269150448
FT-0602774

MDL Number

MFCD04125732

Customs Code

2933399090

FAQ

What regulatory guidelines apply to Methyl 4,6-dichloronicotinate (CAS: 65973-52-6)?

Methyl 4,6-dichloronicotinate (CAS: 65973-52-6) falls under the scope of the REACH regulation in the European Union, which requires companies to provide detailed safety data sheets and register substances above a certain tonnage. Additionally, it is classified under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) as a hazardous chemical. In the USA, the EPA regulates its use and disposal under the Toxic Substances Control Act (TSCA).

Are there alternatives to Methyl 4,6-dichloronicotinate (CAS: 65973-52-6) in synthesis?

Alternatives to Methyl 4,6-dichloronicotinate (CAS: 65973-52-6) include other chlorinated nicotinic acid derivatives or similar compounds such as methyl 4-chloronicotinate. These alternatives may offer different reactivity profiles and are often used depending on the specific synthesis requirements and desired product properties.

What is the market or research trend for Methyl 4,6-dichloronicotinate (CAS: 65973-52-6)?

The market for Methyl 4,6-dichloronicotinate (CAS: 65973-52-6) is driven by its use in pharmaceuticals and agricultural chemicals. Recent research trends focus on its potential as a synthetic intermediate and its role in developing new drugs. Price trends vary based on supply and demand, with the rising demand in the pharmaceutical sector driving prices upwards.

How should waste containing Methyl 4,6-dichloronicotinate (CAS: 65973-52-6) be handled?

Waste containing Methyl 4,6-dichloronicotinate (CAS: 65973-52-6) should be collected in appropriate containers and labeled as hazardous. Incineration is a common disposal method, but professional waste disposal services should be used to ensure compliance with local regulations. Environmental protection measures, such as neutralization and proper storage, are crucial to prevent contamination of soil and water. It is also important to follow all local and national regulations regarding the disposal of hazardous waste.