1-(Methylsulfonyl)-4-piperidinone

Basic Information

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CAS Number

218780-53-1

Molecular Formula

C6H11NO3S

Molecular Weight

177.23 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

102-104°C

Boiling Point

320℃ at 760 mmHg

Density

1.332

Flash Point

320.414 °C at 760 mmHg

Refractive Index

1.522

SMILES

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CS(=O)(=O)N1CCC(=O)CC1

InChI

InChI=1S/C6H11NO3S/c1-11(9,10)7-4-2-6(8)3-5-7/h2-5H2,1H3

InChIKey

RTBFRGCFXZNCOE-UHFFFAOYSA-N

LogP

-0.3890999999999998

Topological Polar Surface Area

54.45 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

242

Safety Information

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Hazard Statement

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

DTXSID70476995
SY024898
1-methanesulphonyl-piperidin-4-one
AM85331
N-(methylsulfonyl)piperidin-4-one
DS-2406
RTBFRGCFXZNCOE-UHFFFAOYSA-N
1-Methanesulfonyl-piperidin-4-one
glutaricacid
1-methanesulfonyl-piperidine-4-one
1-methanesulphonyl-piperidine-4-one
EN300-97622
AKOS000180810
1-methanesulfonyl-4-piperidinone
Z133648288
1-methanesulfonylpiperidin-4-one
FT-0743390
1-methylsulfonylpiperidin-4-one;1-Methylsulfonyl-4-piperidone
SCHEMBL171589
1-(methylsulfonyl)-4-Piperidinone
N-Methanesulfonylpiperidin-4-one
1-Methylsulfonyl-4-piperidone
1-(Methylsulfonyl)-4-piperidinone, AldrichCPR
PS-3895
A815723
1-(Methylsulphonyl)piperidin-4-one
218780-53-1
4-Piperidinone, 1-(methylsulfonyl)-
MFCD08061935
1-methylsulfonylpiperidin-4-one
CS-0112223

MDL Number

MFCD08061935

Customs Code

2935009090

FAQ

What is 1-(Methylsulfonyl)-4-piperidinone (CAS: 218780-53-1)?

1-(Methylsulfonyl)-4-piperidinone is a cyclic amide compound with the chemical formula C8H14NO3S. It has a pungent odor and is used in pharmaceutical and chemical synthesis. The compound is characterized by its stability and reactivity.

What are the main uses of 1-(Methylsulfonyl)-4-piperidinone (CAS: 218780-53-1)?

1-(Methylsulfonyl)-4-piperidinone is primarily used as an intermediate in the synthesis of pharmaceuticals and other organic compounds. It is also used in academic research for the development of new materials and drug candidates.

Is 1-(Methylsulfonyl)-4-piperidinone (CAS: 218780-53-1) safe?

1-(Methylsulfonyl)-4-piperidinone is generally safe when handled with proper precautions. It is important to avoid contact with skin and eyes, and to ensure good ventilation during use. Protective gloves and eyewear should be worn.

How should 1-(Methylsulfonyl)-4-piperidinone (CAS: 218780-53-1) be stored?

1-(Methylsulfonyl)-4-piperidinone should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent moisture absorption. The temperature should be maintained below 25°C, and humidity should be controlled to avoid degradation.