3-Azetidinecarboxamide

Basic Information

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CAS Number

740768-99-4

Molecular Formula

C4H8N2O

Molecular Weight

100.12 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Water Treatment Chemicals Coagulants and Flocculants Inorganic Coagulants

Basic Physical Properties

SMILES

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C1C(CN1)C(=O)N

InChI

InChI=1S/C4H8N2O/c5-4(7)3-1-6-2-3/h3,6H,1-2H2,(H2,5,7)

InChIKey

VALZSZJVEFACEZ-UHFFFAOYSA-N

LogP

-1.3089000000000004

Topological Polar Surface Area

55.120000000000005 Å²

Hydrogen Bond Donor/Acceptor

3 / 3

Complexity

87.7

Synonyms & References

English

F2158-1524
SY032525
AKOS006305027
CS-0053755
3-AZETIDINECARBOXAMIDE
VALZSZJVEFACEZ-UHFFFAOYSA-N
EN300-81881
AM20100716
AS-33442
SCHEMBL1366389
DTXSID40591629
A838006
Azetidine-3-carboxamide
3-AzetidinecarboxaMide HCl
AZETIDINE-3-CARBOXYLIC ACID AMIDE
MFCD10565784
PB14800
J-511747
FT-0684717
740768-99-4
LogP
azetidine-3-carboxamide

MDL Number

MFCD10565784

FAQ

What are the physical and chemical properties of 3-Azetidinecarboxamide (CAS: 740768-99-4)?

3-Azetidinecarboxamide is a white crystalline solid with a molecular weight of approximately 110.11 g/mol. It has a pKa of about 7.1 and is slightly soluble in water. The compound is reactive towards nucleophiles and can undergo amine substitution reactions.

How is 3-Azetidinecarboxamide (CAS: 740768-99-4) typically synthesized?

3-Azetidinecarboxamide can be synthesized via the condensation of azetidine-2-carboxaldehyde with ammonia or aniline. This reaction typically proceeds with good yield and selectivity under basic conditions, often using sodium hydroxide as a catalyst.

What industries use 3-Azetidinecarboxamide (CAS: 740768-99-4)?

3-Azetidinecarboxamide is primarily used in the pharmaceutical industry as an intermediate for the synthesis of various drugs. It also has applications in the polymer industry for the synthesis of functionalized polymers and in the sensor industry for the development of novel gas sensing materials.

What precautions should be taken when handling 3-Azetidinecarboxamide (CAS: 740768-99-4)?

When handling 3-Azetidinecarboxamide, it is important to use appropriate personal protective equipment (PPE) such as gloves, safety goggles, and a lab coat. The compound should be handled in a well-ventilated area or a fume hood. In the event of a spill, it should be cleaned up with great care, using appropriate cleaning agents, and the area should be thoroughly washed down. Always refer to the Safety Data Sheet (SDS) for detailed handling and storage information.