2-Methyl-2-propanyl 4-(2-ethoxy-2-oxoethyl)-1-piperidinecarboxylate

Basic Information

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CAS Number

135716-09-5

Molecular Formula

C14H25NO4

Molecular Weight

271.36 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 Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

339.2±15.0℃ at 760 mmHg

SMILES

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CCOC(=O)CC1CCN(CC1)C(=O)OC(C)(C)C

InChI

InChI=1S/C14H25NO4/c1-5-18-12(16)10-11-6-8-15(9-7-11)13(17)19-14(2,3)4/h11H,5-10H2,1-4H3

InChIKey

PQEXLIRUMIRSAL-UHFFFAOYSA-N

LogP

2.5867000000000004

Topological Polar Surface Area

55.84 Å²

Hydrogen Bond Donor/Acceptor

0 / 5

Complexity

314

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

tert-Butyl 4-(2-ethoxy-2-oxoethyl)piperidine-1-carboxylate
Ethyl N-Boc-4-piperidineacetate
1-Boc-4-Piperidine Acetic Acid Ethyl Ester
Ethyl 1-Boc-4-Piperidine acetate
Ethyl N-BOC-piperidine-4-acetate
N-BOC-4-ETHYL PIPERIDINECARBOXYLATE
1-BOC-4-(2-ETHOXY-2-OXOETHYL)PIPERIDINE
1-tert-butoxycarbonyl-4-ethoxycarbonylmethylpiperidine
1-tert-butoxycarbonylpiperidin-4-acetic acid ethyl ester
2-(1-t-Butoxycarbonyl-4-piperidyl)ethanoic acid ethyl ester
4-Ethyl 1-(2-Methyl-2-Propanyl) 1,4-Piperidinedicarboxylate
ethyl 1-[(1,1-dimethylethoxy)carbonyl]-4-piperidineacetate
tert-butyl 4-(2-ethoxy-2-oxoethyl)-1-piperidine carboxylate
tert-butyl 4-(2-ethoxy-2-oxoethyl)piperidine-1-carboxylate(SALTDATA: FREE)
2-(1-tert-Butoxycarbonyl-4-piperidyl)acetic acid ethyl ester
4-((Ethoxycarbonyl)methyl)piperidine-1-carboxylic acid tert-butyl ester
4-PIPERIDINEACETIC ACID, 1-[(1,1-DIMETHYLETHOXY)CARBONYL]-, ETHYL ESTER
KSC910I5R
PQEXLIRUMIRSAL-UHFFFAOYSA-N
BCP26963
RW1109
4-ethoxycarbonylmethyl-piperidine-1-
tert-butyl 4-(2-ethoxy-2-oxoethyl)piperidine-1-carboxylate

MDL Number

MFCD08275143

Customs Code

2933399090

FAQ

What are the physical and chemical properties of 2-Methyl-2-propanyl 4-(2-ethoxy-2-oxoethyl)-1-piperidinecarboxylate (CAS: 135716-09-5)?

2-Methyl-2-propanyl 4-(2-ethoxy-2-oxoethyl)-1-piperidinecarboxylate is a colorless to slightly yellowish crystalline solid with a molecular weight of approximately 322.35 g/mol. It is slightly soluble in water but soluble in common organic solvents like ethanol and acetone. The compound is relatively stable under normal conditions but reacts with strong bases to form the corresponding salts. It is also known for its reactivity with nucleophiles.

How is 2-Methyl-2-propanyl 4-(2-ethoxy-2-oxoethyl)-1-piperidinecarboxylate (CAS: 135716-09-5) typically synthesized?

2-Methyl-2-propanyl 4-(2-ethoxy-2-oxoethyl)-1-piperidinecarboxylate is typically synthesized via a multistep process involving the condensation of an ethyl 4-bromomethyl-1-piperidinecarboxylate with 2-methylpropyl alcohol, followed by the addition of ethoxyacetaldehyde. This reaction is often catalyzed by a Lewis acid such as zinc chloride, and the final product is isolated by recrystallization. The overall yield is moderate, around 50-60%, depending on the purity of the starting materials and reaction conditions.

What industries use 2-Methyl-2-propanyl 4-(2-ethoxy-2-oxoethyl)-1-piperidinecarboxylate (CAS: 135716-09-5)?

2-Methyl-2-propanyl 4-(2-ethoxy-2-oxoethyl)-1-piperidinecarboxylate is primarily used in the pharmaceutical industry as a precursor for synthesizing complex organic molecules. It is also utilized in the polymer industry for the development of functional polymers. Additionally, it has potential applications in the production of sensors and semiconductors due to its chemical reactivity and stability under various conditions.

What precautions should be taken when handling 2-Methyl-2-propanyl 4-(2-ethoxy-2-oxoethyl)-1-piperidinecarboxylate (CAS: 135716-09-5)?

When handling 2-Methyl-2-propanyl 4-(2-ethoxy-2-oxoethyl)-1-piperidinecarboxylate, it is essential to wear appropriate personal protective equipment (PPE), including safety goggles and gloves. The compound should be stored in a cool, dry, and well-ventilated area away from direct sunlight and heat sources. In case of a spill, it should be handled with care using appropriate absorbents, and the spill site should be cleaned thoroughly. Always refer to the Material Safety Data Sheet (MSDS) for detailed safety information and emergency procedures.