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

Basic Information

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CAS Number

98303-20-9

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

129.0 to 133.0 deg-C

Boiling Point

353.2 °C at 760 mmHg

Density

1.164 g/cm3

Flash Point

167.4℃

SMILES

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CC(C)(C)OC(=O)N1CCCCC1C(=O)O

InChI

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

InChIKey

JQAOHGMPAAWWQO-UHFFFAOYSA-N

LogP

1.8606

Topological Polar Surface Area

66.84 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

282

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

1,2-Piperidinedicarboxylic acid, 1-(1,1-dimethylethyl) ester
n-boc-pipecolic acid
N-t-boc pipecolinic acid
DTXSID70922705
AM20120397
EN300-29703
DL-1-(tert-Butoxycarbonyl)piperidine-2-carboxylic acid
J-505024
SB13883
F0001-2325
(+/-)-N-(tert-Butoxycarbonyl)piperidine-2-carboxylic acid
1-(tert-Butoxycarbonyl)pipecolic Acid
1-(tert-Butoxycarbonyl)pipecolinic Acid
1-(tert-butoxycarbonyl)piperidine-2-carboxylic acid
Z285649230
JQAOHGMPAAWWQO-UHFFFAOYSA-
Piperidine-1,2-dicarboxylic acid-1-tert-butyl ester
1-(tert-Butoxycarbonyl)-2-piperidinecarboxylic acid
InChI=1/C11H19NO4/c1-11(2,3)16-10(15)12-7-5-4-6-8(12)9(13)14/h8H,4-7H2,1-3H3,(H,13,14)
FT-0630131
UNII-E2P5PJ52SH
AKOS016042250
N-Boc-DL-pipecolic acid
FT-0630257
FT-0601670
PS-3746
1-Boc-piperidine-2-carboxylic acid
1-Boc-2-piperidinecarboxylic Acid
1-tert-Butoxycarbonyl-piperidine-2-carboxylic acid
1-(tert-butoxy-carbonyl)piperidine 2 carboxylic acid
(RS)-1-(tert-butyloxycarbonyl)-2-piperidine carboxylic acid

MDL Number

MFCD01862877

Customs Code

2933399090

FAQ

What is 1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-2-piperidinecarboxylic acid (CAS: 98303-20-9)?

1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-2-piperidinecarboxylic acid (CAS: 98303-20-9) is a synthetic organic compound with the molecular formula C9H17NO3. It features a piperidine ring substituted with a tert-butoxycarbonyl (t-Boc) group and a carboxylic acid functional group. This compound is commonly used as an intermediate in pharmaceutical and organic chemistry applications due to its reactivity and structural versatility.

What are the main uses of 1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-2-piperidinecarboxylic acid (CAS: 98303-20-9)?

The primary applications of 1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-2-piperidinecarboxylic acid (CAS: 98303-20-9) include pharmaceutical research for drug development, particularly in the synthesis of bioactive molecules. It is also utilized in organic chemistry as a building block for creating complex compounds, and in industrial processes for chemical intermediates. Its unique structure makes it valuable in the production of therapeutic agents and functional materials.

Is 1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-2-piperidinecarboxylic acid (CAS: 98303-20-9) safe?

Safety of 1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-2-piperidinecarboxylic acid (CAS: 98303-20-9) depends on exposure conditions. While it is generally considered safe in controlled environments, it may cause skin or respiratory irritation. Proper handling with gloves, goggles, and ventilation is recommended. Adherence to OSHA and EPA guidelines ensures safe use, and it should be stored in a secure area away from incompatible substances.

How should 1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-2-piperidinecarboxylic acid (CAS: 98303-20-9) be stored?

To maintain stability and safety, 1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-2-piperidinecarboxylic acid (CAS: 98303-20-9) should be stored in a cool, dry place (ideally below 25°C), protected from light. It requires airtight containers to prevent moisture absorption and contamination. Avoid exposure to heat, humidity, and reactive materials to ensure long-term preservation of its chemical properties.