1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4-piperidinecarboxylic acid

Basic Information

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CAS Number

84358-13-4

Molecular Formula

C11H19NO4

Molecular Weight

229.28 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 Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

White to Yellow Solid

Melting Point

151.0 to 155.0 deg-C

Boiling Point

353.2℃ at 760 mmHg

Density

1.164

Water Solubility

Insoluble in water.

Flash Point

167.4℃

SMILES

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CC(C)(C)OC(=O)N1CCC(CC1)C(=O)O

InChI

InChI=1S/C11H19NO4/c1-11(2,3)16-10(15)12-6-4-8(5-7-12)9(13)14/h8H,4-7H2,1-3H3,(H,13,14)

InChIKey

JWOHBPPVVDQMKB-UHFFFAOYSA-N

LogP

1.7181

Topological Polar Surface Area

66.84 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

274

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

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

N-Boc-Isonipecotic acid
1-Boc-piperidine-4-carboxylicacid
N-Boc-DL-isonipecotic acid
1-(tert-Butoxycarbonyl)isonipecotic acid
1-(tert-Butoxycarbonyl)piperidine-4-carboxylic acid
Boc-DL-Inp-OH
Piperidine-1,4-dicarboxylic acid 1-tert-butyl ester
1-(Tert-butoxycarbonyl)-carboxylic acid
N-BOC-4-Piperidinecarboxylic acid
1-(tert-Butoxycarbonyl)-4-piperidinecarboxylic Acid
1-Boc-isonipecotic acid
1-Benzyl-4-piperidine carboxylic acid
Boc-Inp-OH
Boc-isonipecotic acid
Boc-L-Inp-OH
Boc-piperidine-4-carboxylic acid
N-BOC-piperidine-4-carboxylic acid
1-Boc-4-piperidinecarboxylic Acid
1-Boc-piperidine-4-carboxylic acid
1-Boc-4-piperidine carboxylic acid
1-[(Tert-Butoxy)Carbonyl]Piperidine-4-Carboxylic Acid
1-tert-Butoxycarbonylpiperidine-4-carboxylic acid
1-Boc-isonipecotic Acid
1-(tert-Butoxycarbonyl)isonipecotic Acid
1-Boc-4-piperidinecarboxylic acid
BOC-Isonipecotic acid

MDL Number

MFCD00076999

Customs Code

2933399090

FAQ

What is 1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4-piperidinecarboxylic acid (CAS: 84358-13-4)?

1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4-piperidinecarboxylic acid (CAS: 84358-13-4) is a chemical compound with the molecular formula C10H19NO3. It features a piperidine ring with a carboxylic acid group at the 4-position and a tert-butyl oxy carbonyl substituent. This compound is known for its stability in organic solvents and is commonly used in pharmaceutical and research applications.

What are the main uses of 1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4-piperidinecarboxylic acid (CAS: 84358-13-4)?

This compound is primarily utilized in pharmaceutical research as an intermediate for drug development and as a prodrug candidate. It also serves in organic synthesis to create complex molecules and in biochemical studies for enzyme inhibition applications. Its unique structure makes it valuable in the design of therapeutic agents and functional chemical derivatives.

Is 1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4-piperidinecarboxylic acid (CAS: 84358-13-4) safe?

Safety of 1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4-piperidinecarboxylic acid (CAS: 84358-13-4) depends on handling. It requires protective measures such as gloves, goggles, and a well-ventilated workspace. While no specific toxicity data is widely available, adherence to standard chemical safety protocols is recommended. Consult safety data sheets for detailed guidelines.

How should 1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4-piperidinecarboxylic acid (CAS: 84358-13-4) be stored?

Store 1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4-piperidinecarboxylic acid (CAS: 84358-13-4) in a cool (2-8°C), dry, and dark environment. Keep in a sealed container to prevent moisture exposure. Avoid contact with incompatible substances and ensure proper ventilation to maintain stability and prevent degradation.