2-Azabicyclo[2.2.1]heptane-3-carboxylic acid

Basic Information

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CAS Number

88260-06-4

Molecular Formula

C7H11NO2

Molecular Weight

141.17 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Boiling Point

291.2℃ at 760 mmHg

SMILES

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C1CC2CC1C(N2)C(=O)O

InChI

InChI=1S/C7H11NO2/c9-7(10)6-4-1-2-5(3-4)8-6/h4-6,8H,1-3H2,(H,9,10)

InChIKey

BMVVXSIHLQYXJJ-UHFFFAOYSA-N

LogP

0.2114999999999998

Topological Polar Surface Area

49.33 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

169

Safety Information

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Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

(1R,3S,4R)-2-Azabicyclo[2.2.1]heptane-3-carboxylic acid
2-azabicyclo(2.2.1)heptane-3-carboxylic acid
2-Azabicyclo[2.2.1]heptane-3-carboxylic acid
2‐AZABICYCLO[2.2.1]HEPTANE‐3‐CARBOXYLIC ACID
3-azabicyclo[2.2.1]heptane-2-carboxylic acid
2-Aza-bicyclo[2.2.1]heptane-3-carboxylic acid
2-azabicyclo[2.2.1]heptane-3-carboxylic acid
3-Azabicyclo[2.2.1]heptane-2-carboxylic acid
(1R,3R,4R)-2-azabicyclo[2.2.1]heptane-3-carboxylic acid
2-AZA-BICYCLO[2.2.1]HEPTANE-3-CARBOXYLIC ACID
SCHEMBL993042
Racemic-(1S,3R,4R)-2-Azabicyclo[2.2.1]Heptane-3-Carboxylic Acid
2-Azabicyclo[2.2.1]heptane-3-carboxylic acid, (1R,4S)-rel-
DTXSID30527674
SB21066
DTXCID70478479
W14573
2-azabicyclo[2.2.1]heptane-3-car-boxylic acid
PB34219
MFCD07440107
2089598-14-9
2089587-07-3
CS-0054883
2-ABHCA
(3R)-2-azabicyclo[2.2.1]heptane-3-carboxylic acid
88260-06-4
AKOS002665988
SY100050
MFCD08436673
Z185587016
1902292-36-7

MDL Number

MFCD07440107

Customs Code

2933990090

FAQ

What are the physical and chemical properties of 2-Azabicyclo[2.2.1]heptane-3-carboxylic acid (CAS: 88260-06-4)?

2-Azabicyclo[2.2.1]heptane-3-carboxylic acid is a crystalline solid with a molecular weight of approximately 185.24 g/mol. It is slightly soluble in water and has good solubility in organic solvents like ethanol and acetone. The compound exhibits moderate reactivity, particularly in condensation reactions and esterification. It is stable under normal conditions but should be stored in a cool, dry place away from direct sunlight.

How is 2-Azabicyclo[2.2.1]heptane-3-carboxylic acid (CAS: 88260-06-4) typically synthesized?

2-Azabicyclo[2.2.1]heptane-3-carboxylic acid can be synthesized through a multi-step process that involves the ring-opening of a lactam, followed by acidification and cyclization. Commonly, this involves aminomethylcyclohexanone, which is subjected to ring-opening with a base, followed by cyclization and acidification. The reaction conditions and catalysts used typically include mild bases and acids, with yields ranging from 50-70% depending on the optimization of the process.

What industries use 2-Azabicyclo[2.2.1]heptane-3-carboxylic acid (CAS: 88260-06-4)?

2-Azabicyclo[2.2.1]heptane-3-carboxylic acid is primarily used in the pharmaceutical industry for the synthesis of various drugs and intermediates. It also finds applications in the polymer industry as a monomer for the production of functionalized polymers. Additionally, it is used in the development of sensors and semiconductors, where its unique structure provides specific functionalities.

What precautions should be taken when handling 2-Azabicyclo[2.2.1]heptane-3-carboxylic acid (CAS: 88260-06-4)?

When handling 2-Azabicyclo[2.2.1]heptane-3-carboxylic acid, it is essential to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The substance should be handled in a well-ventilated area or a fume hood. Spills should be cleaned up with appropriate absorbent materials, and the area should be well-ventilated. Always refer to the Safety Data Sheet (SDS) for specific handling and disposal guidelines.