3-Phenyl-3-oxetanamine

Basic Information

View in Editor

CAS Number

1211567-54-2

Molecular Formula

C9H11NO

Molecular Weight

149.19 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

SMILES

View in Editor

NC1(COC1)c2ccccc2

InChI

InChI=1S/C9H11NO/c10-9(6-11-7-9)8-4-2-1-3-5-8/h1-5H,6-7,10H2

InChIKey

XISUWHJCLGQGMS-UHFFFAOYSA-N

LogP

0.8708

Topological Polar Surface Area

35.25 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Synonyms & References

English

3-Phenyloxetan-3-amine
3-phenyl-3-Oxetanamine
3-Phenyl-oxetan-3-ylamine
3-phenyloxetan-3-amine

MDL Number

MFCD18251060

FAQ

What are the physical and chemical properties of 3-Phenyl-3-oxetanamine (CAS: 1211567-54-2)?

3-Phenyl-3-oxetanamine is a crystalline compound with a molecular weight of approximately 156.22 g/mol. It has a low solubility in water but is more soluble in organic solvents. The compound is mildly reactive, particularly with bases and nucleophiles. It exists as a solid at room temperature and is stable under normal conditions.

How is 3-Phenyl-3-oxetanamine (CAS: 1211567-54-2) typically synthesized?

3-Phenyl-3-oxetanamine is usually synthesized via the amide formation between 3-oxetanone and phenylamine under basic conditions. Commonly used catalysts include sodium hydride, and the reaction is typically performed at room temperature. The yield is moderate to good, and the selectivity is high due to the sterically hindered oxetane ring.

What industries use 3-Phenyl-3-oxetanamine (CAS: 1211567-54-2)?

3-Phenyl-3-oxetanamine finds applications in the pharmaceutical industry as an intermediate for the synthesis of various biologically active compounds. It is also used in the polymer industry to improve the properties of certain plastics and in the sensor industry for its reactivity with specific analytes. Additionally, it has potential in the semiconductor industry for modifying surface properties.

What precautions should be taken when handling 3-Phenyl-3-oxetanamine (CAS: 1211567-54-2)?

When handling 3-Phenyl-3-oxetanamine, it is essential to wear appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. Store the compound in a cool, dry place away from heat sources and incompatible materials. Spills should be cleaned up using appropriate techniques and proper disposal methods. Always refer to the Safety Data Sheet (SDS) for detailed handling and safety information.