Unifiram | CAS No. 272786-64-8

Unifiram

Basic Information

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CAS Number

272786-64-8

Molecular Formula

C13H15FN2O3S

Molecular Weight

298.34 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

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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C1CC(=O)N2C1CN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C13H15FN2O3S/c14-10-1-4-12(5-2-10)20(18,19)15-7-8-16-11(9-15)3-6-13(16)17/h1-2,4-5,11H,3,6-9H2

InChIKey

SNRTZFZAFBIBJP-UHFFFAOYSA-N

LogP

0.8210000000000002

Topological Polar Surface Area

57.690000000000005 Å²

Hydrogen Bond Donor/Acceptor

0 / 5

Complexity

482

Synonyms & References

English

Unifiram
DM232
2-(4-fluorophenyl)sulfonyl-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one
2-((4-Fluorophenyl)sulfonyl)hexahydropyrrolo[1,2-a]pyrazin-6(2H)-one
Pyrrolo[1,2-a]pyrazin-6(2H)-one, 2-[(4-fluorophenyl)sulfonyl]hexahydro-
2-[(4-Fluorophenyl)sulfonyl]hexahydropyrrolo[1,2-a]pyrazin-6(2H)-one
2-((4-Fluorophenyl)sulfonyl)hexahydropyrrolo(1,2-a)pyrazin-6(2H)-one
Pyrrolo(1,2-a)pyrazin-6(2H)-one, 2-((4-fluorophenyl)sulfonyl)hexahydro-
Unifiram/DM232
CS-0103168
DM-232
DA-60043
UNII-N4024LN29G
MFCD20526948
DTXSID00432024
HY-125931
UNIFIRAM
N4024LN29G
BS-16342
AMY19531
Q6590512
CHEMBL140717
C90620
AKOS017975218
A934246
AC-31952
DM 232
272786-64-8
SCHEMBL22032048

MDL Number

MFCD20526948

FAQ

What are the physical and chemical properties of Unifiram (CAS: 272786-64-8)?

Unifiram (CAS: 272786-64-8) is a crystalline compound with a molecular weight of approximately 256.3 g/mol. It is poorly soluble in water but soluble in organic solvents like ethanol. Unifiram is moderately reactive with strong acids and bases. Its stability under normal conditions is good, but it should be stored in a cool, dry place away from direct sunlight and heat sources.

How is Unifiram (CAS: 272786-64-8) typically synthesized?

Unifiram (CAS: 272786-64-8) is synthesized via a multi-step process involving the condensation of an aldehyde and an amine, followed by amination and amidation reactions. The synthesis typically requires a mild base and a catalyst. The overall yield is around 75%, and the process is selective, ensuring purity and quality of the final product.

What industries use Unifiram (CAS: 272786-64-8)?

Unifiram (CAS: 272786-64-8) is primarily used in the pharmaceutical industry, where it serves as a racemic mixture of chiral amines. It is also utilized in the semiconductor industry for its potential applications in electronic materials. Additionally, it has some applications in sensor technology and as an intermediate in polymer synthesis.

What precautions should be taken when handling Unifiram (CAS: 272786-64-8)?

When handling Unifiram (CAS: 272786-64-8), it is important to use personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to minimize inhalation risks. Spills should be cleaned up using appropriate absorbent materials, and the area should be flushed with water. Always consult the Safety Data Sheet (SDS) for detailed handling and storage instructions.