Methyl 1-aminocyclohexanecarboxylate

Basic Information

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CAS Number

4507-57-7

Molecular Formula

C8H15NO2

Molecular Weight

157.21 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 Physical Properties

Boiling Point

209.9±23.0 ºC (760 Torr),

Flash Point

79.4±20.1 ºC,

Refractive Index

1.472

SMILES

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COC(=O)C1(CCCCC1)N

InChI

InChI=1S/C8H15NO2/c1-11-7(10)8(9)5-3-2-4-6-8/h2-6,9H2,1H3

InChIKey

KRDTUMQGDPZWMF-UHFFFAOYSA-N

LogP

0.8209999999999995

Topological Polar Surface Area

52.32 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

150

Safety Information

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Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

KRDTUMQGDPZWMF-UHFFFAOYSA-N
SY003290
METHYL1-AMINOCYCLOHEXANOATE
methyl 1-amino-cyclohexanecarboxylate
KL-0010
FT-0649925
methyl 1-aminocyclohexanecarboxylate, AldrichCPR
methyl 1-aminocyclohexanecarboxylate
A826712
METHYL 1-AMINOCYCLOHEXANOATE
DTXSID10398763
1-amino-1-cyclohexanecarboxylic acid methyl ester
Cyclohexanecarboxylic acid, 1-amino-, methyl ester
SCHEMBL240008
1-AMINO-CYCLOHEXANECARBOXYLIC ACID METHYL ESTER
BB 0237264
J-521745
CS-0049254
1-amino-2-methyl-cyclohexanecarboxylate;Methyl 1-Aminocyclohexanoate
4507-57-7
1-aminocyclohexanecarboxylic acid methyl ester
MFCD08686793
ChemDiv2_003263
Methyl 1-aminocyclohexanecarboxylate HYDROCHLORIDE Salt
AKOS000649559
methyl 1-aminocyclohexane-1-carboxylate
HMS1378E07
EN300-35182
trans-amino methyl cyclohexane carboxylic acid
Methyl 1-aminocyclohexanecarboxylate
Methyl-1-aminocyclohexane carboxylate

MDL Number

MFCD08686793

Customs Code

2922499990

FAQ

What regulatory guidelines apply to Methyl 1-aminocyclohexanecarboxylate (CAS: 4507-57-7)?

Methyl 1-aminocyclohexanecarboxylate (CAS: 4507-57-7) is classified under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) as a skin and eye irritant. It is subject to the European Union’s Registration, Evaluation, Authorisation and Restriction of Chemicals (REACH) regulations, which require manufacturers and importers to register substances with the European Chemicals Agency. In the United States, it is regulated by the Environmental Protection Agency (EPA) and the Food and Drug Administration (FDA) for safety and environmental protection.

Are there alternatives to Methyl 1-aminocyclohexanecarboxylate (CAS: 4507-57-7) in synthesis?

Methyl 1-aminocyclohexanecarboxylate (CAS: 4507-57-7) is often used as a starting material in various organic synthesis reactions. Alternative reagents include other aminocarboxylic acids such as methyl 2-aminocyclohexanecarboxylate or methyl 3-aminocyclohexanecarboxylate. Isomers and analogs may also be considered depending on the specific reaction requirements and availability.

What is the market or research trend for Methyl 1-aminocyclohexanecarboxylate (CAS: 4507-57-7)?

The market for Methyl 1-aminocyclohexanecarboxylate (CAS: 4507-57-7) is driven by its use in pharmaceuticals, agrochemicals, and cosmetic industries. Research trends focus on its potential in drug development and as a chiral auxilliary in asymmetric synthesis. The growing demand for sustainable and biocompatible chemicals is also influencing the development of alternatives and the exploration of its applications in eco-friendly products.

How should waste containing Methyl 1-aminocyclohexanecarboxylate (CAS: 4507-57-7) be handled?

Waste containing Methyl 1-aminocyclohexanecarboxylate (CAS: 4507-57-7) should be collected in appropriate containers and stored in a well-ventilated area away from sources of ignition. It should be disposed of through a registered hazardous waste disposal service to ensure compliance with environmental regulations. Incineration is a common method for disposing of chemical waste, but proper incineration conditions must be maintained to prevent the release of harmful by-products. Adequate personal protective equipment (PPE) and safety measures should always be followed during waste handling and disposal.