6-{[(2-Methyl-2-propanyl)oxy]carbonyl}-6-azaspiro[2.5]octane-1-carboxylic acid

Basic Information

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CAS Number

871727-05-8

Molecular Formula

C13H21NO4

Molecular Weight

255.31 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

Boiling Point

392.1±35.0°C at 760 mmHg

SMILES

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CC(C)(C)OC(=O)N1CCC2(CC2C(=O)O)CC1

InChI

InChI=1S/C13H21NO4/c1-12(2,3)18-11(17)14-6-4-13(5-7-14)8-9(13)10(15)16/h9H,4-8H2,1-3H3,(H,15,16)

InChIKey

ZVMOSXHYOPBSRN-UHFFFAOYSA-N

LogP

2.1082

Topological Polar Surface Area

66.84 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

364

Safety Information

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GHS Hazard Pictograms

H319

Hazard Statement

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

6-(tert-Butoxycarbonyl)-6-azaspiro[2.5]octane-1-carboxylic acid
6-Boc-6-azaspiro[2.5]octane-1-carboxylic Acid
6-Azaspiro[2.5]octane-1-carboxylic acid hydrochloride
6-Aza-6-(tert-butoxycarbonyl)spiro[2.5]octane-1-carboxylic acid
6-Aza-spiro[2.5]octane-1,6-dicarboxylic acid 6-tert-butyl ester
6-Azaspiro[2.5]octane-1-carboxylic acid,N-BOC protected
6-tert-butyl 6-azaspiro[2.5]octane-1,6-dicarboxylate
6-(tert-butoxycarbonyl)-6-azaspiro[2.5]octane-1-carboxylic acid(SALTDATA: FREE)
6-[(tert-butoxy)carbonyl]-6-azaspiro[2.5]octane-1-carboxylic acid
6-[(2-methylpropan-2-yl)oxycarbonyl]-6-azaspiro[2.5]octane-2-carboxylic acid
AMSP00003
ZVMOSXHYOPBSRN-UHFFFAOYSA-N
1-Cbz-Spiroindoline-3,4-piperidine
SBB101601
WT1151
DE-

MDL Number

MFCD11007805

Customs Code

2933990090

FAQ

What are the physical and chemical properties of 6-{[(2-Methyl-2-propanyl)oxy]carbonyl}-6-azaspiro[2.5]octane-1-carboxylic acid (CAS: 871727-05-8)?

6-{[(2-Methyl-2-propanyl)oxy]carbonyl}-6-azaspiro[2.5]octane-1-carboxylic acid is a white crystalline solid with a molecular weight of approximately 264.38 g/mol. It is slightly soluble in water and more soluble in organic solvents. The compound exhibits moderate reactivity, especially towards nucleophiles. It is stable under normal laboratory conditions but should be stored in a cool, dry place to avoid degradation.

How is 6-{[(2-Methyl-2-propanyl)oxy]carbonyl}-6-azaspiro[2.5]octane-1-carboxylic acid (CAS: 871727-05-8) typically synthesized?

6-{[(2-Methyl-2-propanyl)oxy]carbonyl}-6-azaspiro[2.5]octane-1-carboxylic acid is synthesized via a multi-step process involving the protection of spiro lactam followed by acylation and deprotection. Commonly, a protected spiro compound is treated with a suitable acylating agent in the presence of a catalyst, followed by deprotection to yield the target product with high yield and good selectivity.

What industries use 6-{[(2-Methyl-2-propanyl)oxy]carbonyl}-6-azaspiro[2.5]octane-1-carboxylic acid (CAS: 871727-05-8)?

6-{[(2-Methyl-2-propanyl)oxy]carbonyl}-6-azaspiro[2.5]octane-1-carboxylic acid is primarily used in the pharmaceutical industry for the synthesis of biologically active compounds. It is also utilized in the development of certain sensors and as a precursor in organic synthesis for the production of various functional materials.

What precautions should be taken when handling 6-{[(2-Methyl-2-propanyl)oxy]carbonyl}-6-azaspiro[2.5]octane-1-carboxylic acid (CAS: 871727-05-8)?

When handling 6-{[(2-Methyl-2-propanyl)oxy]carbonyl}-6-azaspiro[2.5]octane-1-carboxylic acid (CAS: 871727-05-8), it is important to use personal protective equipment (PPE) such as gloves and safety glasses. This compound should be used in a well-ventilated area or a fume hood to avoid inhalation of vapor. Spills should be handled with care, using appropriate absorbents, and the material safety data sheet (MSDS) should be consulted for detailed procedures. Storage should be in a cool, dry place, and the compound should be kept away from heat sources and direct sunlight.