2-Methyl-2-propanyl 3-ethynyl-1-piperidinecarboxylate

Basic Information

View in Editor

CAS Number

664362-16-7

Molecular Formula

C12H19NO2

Molecular Weight

16.04 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

269.6°C at 760 mmHg

Density

1.02

SMILES

View in Editor

CC(C)(C)OC(=O)N1CCCC(C1)C#C

InChI

InChI=1S/C12H19NO2/c1-5-10-7-6-8-13(9-10)11(14)15-12(2,3)4/h1,10H,6-9H2,2-4H3

InChIKey

IJHRDEPFBAXIMW-UHFFFAOYSA-N

LogP

0.6361

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

282

Safety Information

View Safety Information

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H332 Harmful if inhaled
Acute toxicity, inhalation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

1-Piperidinecarboxylic acid, 3-ethynyl-, 1,1-dimethylethyl ester
IJHRDEPFBAXIMW-UHFFFAOYSA-N
SB13861
SB13862
MFCD10698159
A835464
FT-0660290
DS-13114
SCHEMBL192227
DTXSID10620879
3-ETHYNYL-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
1-Boc-3-Ethynylpiperidine
CS-W003948
EN300-71552
3-ethynyl-1-piperidinecarboxylic acid tert-butyl ester
PB13299
SY042117
AKOS016003745
J-524538
AM20100610
tert-butyl 3-ethynylpiperidine-1-carboxylate
664362-16-7
1-PIPERIDINECARBOXYLIC ACID, 3-ETHYNYL-, 1,1-DIMETHYLETHYL ESTER
3-Ethynyl-1-piperidinecarboxylicacid1,1-dimethylethylester
3-Ethynyl-piperidine-1-carboxylic acid tert-butyl ester
tert-Butyl 3-ethynylpiperidine-1-carboxylate
tert-butyl (3S)-3-ethynylpiperidine-1-carboxylate
1-Piperidinecarboxylic acid, 3-ethynyl-, 1,1-dimethylethyl esteR, (3R)-
PubChem18396
1-N-Boc-3-ethynylpiperidine
0209AC

MDL Number

MFCD10698159

FAQ

What regulatory guidelines apply to 2-Methyl-2-propanyl 3-ethynyl-1-piperidinecarboxylate (CAS: 664362-16-7)?

2-Methyl-2-propanyl 3-ethynyl-1-piperidinecarboxylate (CAS: 664362-16-7) falls under the regulatory guidelines of the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), including classification for health, environmental, and physical hazards. In the European Union, it is also subject to REACH regulations, which require registration and evaluation of substances. For FDA and EPA purposes, it is important to ensure that the compound complies with relevant health and environmental standards.

Are there alternatives to 2-Methyl-2-propanyl 3-ethynyl-1-piperidinecarboxylate in synthesis?

Alternatives to 2-Methyl-2-propanyl 3-ethynyl-1-piperidinecarboxylate in synthesis include similar piperidine derivatives or other ethynyl-containing compounds. Common alternatives might include 3-ethynylpiperidine or related cyclic compounds. These can be used as effective substitutes depending on the specific chemical reaction requirements.

What is the market or research trend for 2-Methyl-2-propanyl 3-ethynyl-1-piperidinecarboxylate (CAS: 664362-16-7)?

The market for 2-Methyl-2-propanyl 3-ethynyl-1-piperidinecarboxylate (CAS: 664362-16-7) is currently growing due to its application in pharmaceuticals and research. Recent trends indicate increased interest in its use as a building block for medicinal chemistry and drug discovery. Research is focusing on exploring its biological activities and potential in novel therapeutic applications.

How should waste containing 2-Methyl-2-propanyl 3-ethynyl-1-piperidinecarboxylate (CAS: 664362-16-7) be handled?

Waste containing 2-Methyl-2-propanyl 3-ethynyl-1-piperidinecarboxylate (CAS: 664362-16-7) should be collected in appropriate containers, ensuring proper labeling and segregation. The waste should be disposed of through professional waste disposal services that comply with local and international regulations. Environmental protection measures, such as neutralization or incineration, should be followed to minimize environmental impact.