1-Isobutyl-4-piperidinone

Basic Information

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CAS Number

72544-16-2

Molecular Formula

C9H17NO

Molecular Weight

155.24 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

28°C (estimate)

Boiling Point

220 °C

Density

0.914 g/mL at 25 °C

Refractive Index

n20/D 1.456(lit.)

SMILES

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CC(C)CN1CCC(=O)CC1

InChI

InChI=1S/C9H17NO/c1-8(2)7-10-5-3-9(11)4-6-10/h8H,3-7H2,1-2H3

InChIKey

KMTASGXMTBUSSP-UHFFFAOYSA-N

LogP

1.3073000000000001

Topological Polar Surface Area

20.310000000000002 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

133

Synonyms & References

English

EN300-54892
1-Isobutylpiperidin-4-one
AKOS000187708
1-(2-Methylpropyl)-4-piperidone
Rifabutin impurity A, European Pharmacopoeia (EP) Reference Standard
N-ISOBUTYL-4-PIPERIDINONE
1-(2-methylpropyl)piperidin-4-one
n-isobutyl-4-piperidone
NS00037383
Rifabutin impurity A
1-(2-Methylpropyl)-4-piperidone, 97%
MFCD00190595
WL7MDR2ZN2
CS-W010924
1-(2-METHYLPROPYL)-4-PIPERIDINONE
RIFABUTIN IMPURITY A [EP IMPURITY]
AMY6027
KMTASGXMTBUSSP-UHFFFAOYSA-N
FT-0672186
DS-2384
72544-16-2
1-Isobutyl-4-piperidone
DTXSID70222858
SB41108
1-(2-methylpropyl)-4-Piperidinone; 1-(2-Methylpropyl)-4-piperidone; 1-(2-Methylpropyl)piperidin-4-one; 1-Isobutyl-4-piperidinone; 1-Isobutyl-4-piperidone; N-Isobutyl-4-piperidinone
XCA54416
SCHEMBL1181641
SY002156
UNII-WL7MDR2ZN2
4-Piperidinone, 1-(2-methylpropyl)-
A9434

MDL Number

MFCD00190595

Customs Code

2933399090

FAQ

What is 1-Isobutyl-4-piperidinone (CAS: 72544-16-2)?

1-Isobutyl-4-piperidinone is an organic compound with the CAS number 72544-16-2. It is a colorless or slightly yellow liquid with a characteristic odor. The chemical formula is C8H15NO. This compound is used in various applications including pharmaceuticals, as a fragrance, and as a solvent in some industrial processes.

What are the main uses of 1-Isobutyl-4-piperidinone (CAS: 72544-16-2)?

1-Isobutyl-4-piperidinone is primarily used in the pharmaceutical industry as an intermediate in the synthesis of other compounds. It is also used as a fragrance in perfumes and as a solvent in some industrial processes. In the food industry, it can be used as a flavoring agent.

Is 1-Isobutyl-4-piperidinone (CAS: 72544-16-2) safe?

1-Isobutyl-4-piperidinone is generally considered safe for its intended uses, but it should be handled with care. It is classified as slightly toxic and may cause skin irritation. Proper protective measures, such as gloves and protective eyewear, should be worn during handling. It is important to follow safety guidelines and use in well-ventilated areas.

How should 1-Isobutyl-4-piperidinone (CAS: 72544-16-2) be stored?

1-Isobutyl-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. Avoid storing in areas with high humidity and maintain a temperature below 30°C (86°F).