Tert-butyl 4-carbamoylpiperidine-1-carboxylate

Basic Information

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CAS Number

91419-48-6

Molecular Formula

C11H20N2O3

Molecular Weight

228.29 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 Amines

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

164.0 to 168.0 deg-C

Boiling Point

384.4°Cat760mmHg

Density

1.123

Flash Point

186.3°C

Refractive Index

1.498

SMILES

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

InChI

InChI=1S/C11H20N2O3/c1-11(2,3)16-10(15)13-6-4-8(5-7-13)9(12)14/h8H,4-7H2,1-3H3,(H2,12,14)

InChIKey

YHFUWPUJUMZXBD-UHFFFAOYSA-N

LogP

1.1188

Topological Polar Surface Area

72.63 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

275

Safety Information

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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

Synonyms & References

English

1-N-Boc-Piperidine-4-carboxamide
1-Piperidinecarboxylic acid, 4-(aminocarbonyl)-, 1,1-dimethylethyl ester
1-(tert-Butoxycarbonyl)-4-piperidinecarboxamide
1-Boc-Piperidine-4-Carboxamide
1-(TERT-BUTOXYCARBONYL)PIPERIDINE-4-CARBOXAMIDE
N-Boc-4-Piperidinecarboxamide
tert-Butyl 4-(aminocarbonyl)-piperidine-1-carboxylate
TERT-BUTYL 4-(AMINOCARBONYL)TETRAHYDROPYRIDINE-1(2H)-CARBOXYLATE
tert-butyl 4-carbamoylpiperidine-1-carboxylate
1-Boc-4-piperidinecarboxamide
tert-Butyl 4-Carbamoyl-1-piperidinecarboxylate
4-Carbamoyl-1-piperidinecarboxylic Acid tert-Butyl Ester
tert-Butyl 4-(aminocarbonyl)tetrahydropyridine-1-carboxylate
N-BOC-4-Piperidine Carboxamide
1-N-Boc-4-piperidinecarboxamide
1-N-Boc-Isonipecotamide
4-CARBAMOYL-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
1-tert-butoxycarbonylpiperidine-4-carboxamide
1-
1,1-Dimethylethyl 4-(aminocarbonyl)-1-piperidinecarboxylate (ACI)
1-tert-Butoxycarbonylpiperidine-4-carboxamide
1-tert-Butoxycarbonylpiperidyl-4-carboxamide
1-tert-Butyloxycarbonyl piperidine-4-carboxylic acid amide
4-Carbamoyl-piperidine-1-carboxylic acid tert-butyl ester
N-tert-Butoxycarbonylpiperidine-4-carboxamide
tert-Butyl 4-carbamoylpiperidine-1-carboxylate
1-BOC-4-piperidinecarboxamide
DB-013747
B3892
91419-48-6
EN300-56514

MDL Number

MFCD02180953

Customs Code

2933399090

FAQ

What is Tert-butyl 4-carbamoylpiperidine-1-carboxylate (CAS: 91419-48-6)?

Tert-butyl 4-carbamoylpiperidine-1-carboxylate (CAS: 91419-48-6) is an organic compound featuring a tert-butyl group, a piperidine ring with carbamoyl and carboxylate functionalities. Its chemical formula is C12H23NO3. This compound is typically a white solid with moderate solubility in organic solvents. It is valued for its stability and reactivity in chemical synthesis, making it a key intermediate in pharmaceutical and research applications. The molecule combines the structural versatility of piperidine with carbamate derivatives, enhancing its utility in drug development.

What are the main uses of Tert-butyl 4-carbamoylpiperidine-1-carboxylate (CAS: 91419-48-6)?

Tert-butyl 4-carbamoylpiperidine-1-carboxylate (CAS: 91419-48-6) is primarily used in pharmaceutical research as a precursor for developing drugs targeting neurological disorders. It also serves in the synthesis of agrochemicals and specialty chemicals due to its functional groups. In laboratory settings, it acts as a building block for creating complex molecules with amide and ester functionalities. Its applications span drug discovery, organic synthesis, and chemical innovation, leveraging its structural adaptability and reactivity.

Is Tert-butyl 4-carbamoylpiperidine-1-carboxylate (CAS: 91419-48-6) safe?

Tert-butyl 4-carbamoylpiperidine-1-carboxylate (CAS: 91419-48-6) is generally considered safe when handled properly. However, it is advisable to wear gloves, goggles, and a lab coat to avoid skin or eye contact. Work in a well-ventilated area or fume hood to minimize inhalation risks. While not classified as highly toxic, safety protocols should follow standard chemical handling guidelines. Always consult the Safety Data Sheet (SDS) for specific precautions and regulatory compliance.

How should Tert-butyl 4-carbamoylpiperidine-1-carboxylate (CAS: 91419-48-6) be stored?

Tert-butyl 4-carbamoylpiperidine-1-carboxylate (CAS: 91419-48-6) should be stored in a cool (2-8°C), dry, and light-protected environment. Keep it in airtight containers made of glass or plastic to prevent moisture ingress and maintain stability. Avoid exposure to heat or humidity to preserve its chemical integrity. Store away from incompatible substances and ensure proper labeling for safe handling. Regularly check storage conditions to ensure long-term preservation.