2-Isopropyl-5-methylcyclohexanone

Basic Information

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CAS Number

10458-14-7

Molecular Formula

C10H18O

Molecular Weight

154.25 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Physical Properties

Melting Point

-6 ºC

Boiling Point

85-88 °C/12 mmHg

Solubility

0.00 M

Refractive Index

n20/D 1.449-1.451

Odor

Slight peppermint odor

SMILES

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CC(C)C1CCC(C)CC1=O

InChI

InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-9H,4-6H2,1-3H3

InChIKey

NFLGAXVYCFJBMK-UHFFFAOYSA-N

LogP

2.6477000000000013

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

149

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled
Sensitization, respiratory

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

2-Isopropyl-5-methylcyclohexanone
4-ISOPROPYL-1-METHYLCYCLOHEXAN-3-ONE
DL-MENTHONE
(+/-)-MENTHONE
MENTHONE
MENTHONE, (+/-)-
P-MENTHAN-3-ONE
P-MENTHA-3-ONE
5-Methyl-2-isopropylcyclohexanone
Menthone (Mixture of Diastereomers)
MENTHONE(AS)
Menthone, Mixture of Isomers
(-)-MENTHONE
5-METHYL-2-(1-METHYLETHYL)CYCLOHEXANONE
5-methyl-2-(propan-2-yl)cyclohexan-1-one
CYCLOHEXANONE,5-METHYL-2-(1-METHYLETHYL)-
L-MENTHONE
MENTHON, ISOMERENGEMISCH
MENTHONE(SG)
p-menthan-
MENTHONE 95
p-Menthanone
5-Methyl-2-(1-methylethyl)cyclohexanone
Menthone

MDL Number

MFCD00062998

Customs Code

29142990

FAQ

What is 2-Isopropyl-5-methylcyclohexanone (CAS: 10458-14-7)?

2-Isopropyl-5-methylcyclohexanone (CAS: 10458-14-7) is an organic compound with the chemical formula C10H16O. It features a cyclohexanone ring substituted with an isopropyl group at position 2 and a methyl group at position 5. This compound is known for its aromatic properties and is commonly used as a synthetic intermediate in organic chemistry. Its structure makes it valuable in the development of complex molecules for various applications.

What are the main uses of 2-Isopropyl-5-methylcyclohexanone (CAS: 10458-14-7)?

2-Isopropyl-5-methylcyclohexanone (CAS: 10458-14-7) is primarily used in pharmaceuticals as a building block for drug synthesis. It also serves in industrial processes for creating specialized chemicals and in research for studying reaction mechanisms. Additionally, it may be utilized in the fragrance and flavor industry due to its aromatic nature. Its versatility makes it a key compound in organic chemistry applications.

Is 2-Isopropyl-5-methylcyclohexanone (CAS: 10458-14-7) safe?

2-Isopropyl-5-methylcyclohexanone (CAS: 10458-14-7) is not classified as highly toxic, but it requires proper handling. Safety precautions include working in a well-ventilated area and using appropriate PPE to avoid skin or respiratory exposure. It is flammable and should be handled according to OSHA guidelines. While it meets safety standards for controlled use, care must be taken to prevent accidental contact or inhalation.

How should 2-Isopropyl-5-methylcyclohexanone (CAS: 10458-14-7) be stored?

2-Isopropyl-5-methylcyclohexanone (CAS: 10458-14-7) should be stored in a cool, dry, and dark place to maintain stability. It is best kept in a sealed, airtight container to prevent exposure to air and moisture. Avoid storage near strong oxidizers or incompatible substances. Ensure proper labeling and follow recommended storage conditions to ensure safety and longevity.