6-Isopropyl-3-methyl-2-cyclohexen-1-one

Basic Information

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CAS Number

89-81-6

Molecular Formula

C10H16O

Molecular Weight

152.24 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Physical Properties

Melting Point

-29°C

Boiling Point

235°C

Density

0,93 g/cm3

Flash Point

90.9±9.8 °C

Solubility

N/A

Refractive Index

-60 ° (C=4, benzene)

Vapor Pressure

0.1±0.4 mmHg at 25°C

SMILES

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CC(C)C1CCC(=CC1=O)C

InChI

InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)6-10(9)11/h6-7,9H,4-5H2,1-3H3

InChIKey

YSTPAHQEHQSRJD-UHFFFAOYSA-N

LogP

2.567800000000001

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

189

Safety Information

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Hazard Statement

H227 Combustible liquid
Flammable liquids

H303 May be harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

Storage Conditions

2-8℃

Synonyms & References

English

PIPERITONE
PIPERITONE(SG)
ALPHA-PIPERITONE
3-Carvomenthenone
1-P-MENTHEN-3-ONE
P-MENTH-1-EN-3-ONE
PIPERITONE WITH GC
p-Mentha-1-ene-3-one
Piperitone (mixture of enantiomers, predominantly (R)-(-)-form)
1-Methyl-4-isopropyl-1-cyclohexen-3-one
2-Cyclohexen-1-one,3-methyl-6-(1-methylethyl)-
Piperiton
PIPERITONE(AS)
3-methyl-6-(1-methylethyl)-2-cyclohexen-1-one
3-methyl-6-isopropylcyclohex-2-en-1-one
6-isopropyl-3-methyl-2-cyclohexen-1-one
6-isopropyl-3-methylcyclohex-2-en-1-one
cinchonidine
PIPERTONE
6-Isopropyl-3-methyl-2-cyclohexen-1-one (mixture of enantiomers, predominantly (R)-(-)-form)
p-Menth-1-en-3-one (mixture of enantiomers, predominantly (R)-(-)-form)
DL-Piperitone
6-Isopropyl-3-methylcyclohex-2-enone
2-Cyclohexen-1-one, 3-methyl-6-(1-methylethyl)-
3-methyl-6-(propan-2-yl)cyclohex-2-en-1-one
YSTPAHQEHQSRJD-UHFFFAOYSA-N
2-Cyclohexen-1-one,3-methyl-6-(1-methylethyl)-, (6S)-
Iso
p-menth-1-en-3-one
1-methyl-4-isopropyl-1-cyclohexen-3-one
3-Methyl-6-(1-methylethyl)-2-cyclohexen-1-one

MDL Number

MFCD00045532

Customs Code

2914299000

FAQ

What regulatory guidelines apply to 6-Isopropyl-3-methyl-2-cyclohexen-1-one (CAS: 89-81-6)?

6-Isopropyl-3-methyl-2-cyclohexen-1-one (CAS: 89-81-6) is regulated under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations in the EU, and by the FDA and EPA in the USA. Specific handling and storage guidelines, protective equipment, and disposal methods must comply with these regulations to ensure safety and regulatory compliance.

Are there alternatives to 6-Isopropyl-3-methyl-2-cyclohexen-1-one in synthesis?

Several alternatives can be used in the synthesis of 6-Isopropyl-3-methyl-2-cyclohexen-1-one (CAS: 89-81-6), such as other ketones like 6-tert-butyl-3-methyl-2-cyclohexen-1-one or using different isomers. These alternatives may offer advantages in reactivity, cost, or availability, depending on the specific application.

What is the market or research trend for 6-Isopropyl-3-methyl-2-cyclohexen-1-one (CAS: 89-81-6)?

The market for 6-Isopropyl-3-methyl-2-cyclohexen-1-one (CAS: 89-81-6) is growing due to its increasing use in fragrance and flavor applications. Research trends focus on developing more sustainable and cost-effective synthesis methods, as well as exploring its potential in other industries such as pharmaceuticals and cosmetics.

How should waste containing 6-Isopropyl-3-methyl-2-cyclohexen-1-one (CAS: 89-81-6) be handled?

Waste containing 6-Isopropyl-3-methyl-2-cyclohexen-1-one (CAS: 89-81-6) should be collected in sealed, labeled containers and disposed of through professional waste disposal services. Proper handling includes neutralization and incineration under controlled conditions to minimize environmental impact and ensure safety.