Ethyl 6-aminonicotinate

Basic Information

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CAS Number

39658-41-8

Molecular Formula

C8H10N2O2

Molecular Weight

166.18 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 Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

149-151°C

Boiling Point

314.7℃ at 760 mmHg

Density

1.192

Flash Point

144.1℃

SMILES

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CCOC(=O)C1=CN=C(C=C1)N

InChI

InChI=1S/C8H10N2O2/c1-2-12-8(11)6-3-4-7(9)10-5-6/h3-5H,2H2,1H3,(H2,9,10)

InChIKey

FIKVWPJKNMTBBD-UHFFFAOYSA-N

LogP

0.8405

Topological Polar Surface Area

65.21000000000001 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

161

Safety Information

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GHS Hazard Pictograms

H319

Hazard Statement

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

6-Amino nicotinic acid ethyl ester
AC-5746
NSC-37818
Ethyl 2-Aminopyridine-5-carboxylate
CHEMBL5200315
Ethyl2-Aminopyridine-5-carboxylate
EN300-189469
AKOS005259098
ethyl 6-aminopyridine-3-carboxylate
39658-41-8
Ethyl 6-aminonicotinate, AldrichCPR
Ethyl 6-Aminonicotinate
ethyl 6-amino-nicotinate
SCHEMBL465881
6-aminonicotinic acid ethyl ester
J-521170
NSC37818
SY002470
MFCD04972544
ethyl-6-amino-nicotinate
2-amino-5-pyridine carboxylic acid ethyl ester
AM10028
6-Amino-3-pyridine carboxylic acid ethyl ester
AS-5687
FT-0651284
FIKVWPJKNMTBBD-UHFFFAOYSA-N
CS-W019557
DTXSID20284587
2-amino-5-pyridinecarboxylic acid ethyl ester
Ethyl 6-aminonicotinate
6-Amino-3-pyridinecarboxylic acid ethyl ester

MDL Number

MFCD04972544

Customs Code

2933399090

FAQ

What regulatory guidelines apply to Ethyl 6-aminonicotinate (CAS: 39658-41-8)?

Ethyl 6-aminonicotinate (CAS: 39658-41-8) is subject to various regulatory guidelines. Under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), it is classified according to its physical and chemical properties. In the European Union, it is regulated under REACH (Registration, Evaluation, Authorization and Restriction of Chemicals) and requires registration if used in industrial quantities. In the USA, the Environmental Protection Agency (EPA) and the Food and Drug Administration (FDA) have specific requirements for its handling and storage, particularly concerning its potential environmental and health impacts.

Are there alternatives to Ethyl 6-aminonicotinate (CAS: 39658-41-8) in synthesis?

Yes, there are alternatives to Ethyl 6-aminonicotinate (CAS: 39658-41-8) in synthesis. Ethyl 6-aminonicotinate is an electrophilic aromatic substitution product, and similar compounds such as ethyl nicotinate or other aminonitro compounds can be used as alternatives. Commonly, researchers may explore ethyl 5-aminonicotinate or similar derivatives depending on the specific reaction conditions and desired product characteristics.

What is the market or research trend for Ethyl 6-aminonicotinate (CAS: 39658-41-8)?

The market for Ethyl 6-aminonicotinate (CAS: 39658-41-8) is driven by its use in pharmaceuticals and as an intermediate in the synthesis of various organic compounds. Recent research trends focus on its application in the development of new drugs and in the design of more sustainable synthesis pathways. Increasingly, there is a trend towards green chemistry principles, including the use of safer solvents and alternatives to hazardous substances, which may influence future research and market trends.

How should waste containing Ethyl 6-aminonicotinate (CAS: 39658-41-8) be handled?

Waste containing Ethyl 6-aminonicotinate (CAS: 39658-41-8) should be handled according to local environmental regulations. Typically, it should be collected in appropriate containers, labeled with the chemical name and CAS number, and disposed of through a licensed hazardous waste management facility. Incineration is a common method for disposing of hazardous organic waste, but this should be done in an enclosed incinerator to minimize environmental impact. Proper precautions should be taken to prevent accidental release during collection and disposal, and all personnel should be trained in safe handling procedures.