(S)-5-(tert-Butoxycarbonyl)-5-azaspiro[2.4]heptane-6-carboxylic acid

Basic Information

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CAS Number

1129634-44-1

Molecular Formula

C12H19NO4

Molecular Weight

241.29 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 Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

377.4±35.0°C at 760 mmHg

SMILES

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CC(C)(C)OC(=O)N1CC2(CC2)CC1C(=O)O

InChI

InChI=1S/C12H19NO4/c1-11(2,3)17-10(16)13-7-12(4-5-12)6-8(13)9(14)15/h8H,4-7H2,1-3H3,(H,14,15)/t8-/m0/s1

InChIKey

VEIYKHIPSJIVRK-QMMMGPOBSA-N

LogP

1.8606

Topological Polar Surface Area

66.84 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

354

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

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

(S)-5-(tert-Butoxycarbonyl)-5-azaspiro[2.4]heptane-6-carboxylic acid
(6S)-5-(tert-butoxycarbonyl)-5-azaspiro[2.4]heptane-6-carboxylic acid
(6S)-5-[(2-methylpropan-2-yl)oxycarbonyl]-5-azaspiro[2.4]heptane-6-carboxylic acid
(6S)-5-[(tert-butoxy)carbonyl]-5-azaspiro[2.4]heptane-6-carboxylic acid
(S)-5-(tert-Butoxycarbonyl)-5-azaspiro [2.4]heptane-6-carboxylic acid
(S)-5-BOC-5-AZASPIRO[2.4]HEPTANE-6-CARBOXYLIC ACID
5-Azaspiro[2.4]heptane-5,6-dicarboxylic acid, 5-(1,1-dimethylethyl) ester, (6S)-
(s)-5-(tert-butoxycarbonyl)-5-azaspiro(2.4)heptane-6-carboxylic acid
(6R)-5-[(tert-butoxy)carbonyl]-5-azaspiro[2.4]heptane-6-carboxy
(6S)-5-tert-butoxycarbonyl-5-azaspiro[2.4]heptane-6-carboxylic acid
MFCD11099673
SCHEMBL193274
AC-28381
(6S)-5-Boc-5-azaspiro[2.4]heptane-6-carboxylic acid
DS-16827
EN300-39139
AKOS010366500
1129634-44-1
(5S)-6-tert-butoxycarbonyl-6-azaspiro[2.4]heptane-5-carboxylic acid
AMY4209
(S)-5-(tert-Butoxycarbonyl)-5-azaspiro[2.4]heptane-6-carboxylicacid
CS-M2570
DTXSID40653857
(S)-5 -(tert-butoxycarbonyl)-5-azaspiro[2.4]heptane-6-carboxylic acid
(6S)-5-(TERT-BUTOXYCARBONYL)-5-AZASPIRO[2.4]HEPTANE-6-CARBOXYLIC ACID
VEIYKHIPSJIVRK-QMMMGPOBSA-N

MDL Number

MFCD11099673

FAQ

What are the physical and chemical properties of (S)-5-(tert-Butoxycarbonyl)-5-azaspiro[2.4]heptane-6-carboxylic acid (CAS: 1129634-44-1)?

(S)-5-(tert-Butoxycarbonyl)-5-azaspiro[2.4]heptane-6-carboxylic acid is a white or off-white solid with a molecular weight of approximately 262.33 g/mol. It has a solubility of about 3.2 mg/mL in water and can be dissolved in organic solvents like methanol and acetonitrile. This compound is known for its low reactivity under standard conditions, but it can undergo hydrolysis under acidic or basic conditions. It is stable under ambient conditions but should be stored in a cool, dry place to prevent degradation.

How is (S)-5-(tert-Butoxycarbonyl)-5-azaspiro[2.4]heptane-6-carboxylic acid (CAS: 1129634-44-1) typically synthesized?

(S)-5-(tert-Butoxycarbonyl)-5-azaspiro[2.4]heptane-6-carboxylic acid can be synthesized through a multistep process involving the formation of a tert-butoxycarbonyl protected derivative from its parent azaspiro compound. The synthesis typically involves protecting groups, such as tert-butoxycarbonyl (Boc), to enhance chemical reactivity and control the reaction pathway. The final product is obtained through careful purification steps and is often used in the subsequent synthesis of more complex molecules.

What industries use (S)-5-(tert-Butoxycarbonyl)-5-azaspiro[2.4]heptane-6-carboxylic acid (CAS: 1129634-44-1)?

(S)-5-(tert-Butoxycarbonyl)-5-azaspiro[2.4]heptane-6-carboxylic acid is primarily used in the pharmaceutical industry for the synthesis of drugs and intermediates. It is also utilized in the polymer industry for the development of novel materials and in the sensor industry for its ability to interact with specific analytes. Additionally, this compound may find application in the semiconductor industry due to its potential use in functionalization of surfaces for electronic applications.

What precautions should be taken when handling (S)-5-(tert-Butoxycarbonyl)-5-azaspiro[2.4]heptane-6-carboxylic acid (CAS: 1129634-44-1)?

When handling (S)-5-(tert-Butoxycarbonyl)-5-azaspiro[2.4]heptane-6-carboxylic acid, it is essential to wear appropriate personal protective equipment (PPE), including gloves, safety goggles, and lab coat. This compound should be used in a well-ventilated area, and the use of a fume hood is recommended to minimize exposure. Spills should be cleaned up promptly using appropriate absorbents, and the material safety data sheet (MSDS) should always be consulted for detailed safety information and emergency procedures. Storage should be in a cool, dry place, away from direct sunlight and heat sources.