3,5-Dimethylcyclohexanone

Basic Information

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CAS Number

2320-30-1

Molecular Formula

C8H14O

Molecular Weight

126.2 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Physical Properties

Melting Point

9.25°C (estimate)

Boiling Point

179.85°C

Refractive Index

1.4410-1.4440

SMILES

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CC1CC(CC(=O)C1)C

InChI

InChI=1S/C8H14O/c1-6-3-7(2)5-8(9)4-6/h6-7H,3-5H2,1-2H3

InChIKey

MSANHHHQJYQEOK-UHFFFAOYSA-N

LogP

2.0116

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

106

Safety Information

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Hazard Statement

H226 Flammable liquid and vapor
Flammable liquids

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class 3 Class 3

Synonyms & References

English

NSC-21132
3,5-Dimethylcyclohexanone
A878307
NS00114004
Cyclohexanone, 3,5-dimethyl-
LS-13471
NSC21132
3,5-Dimethyl cyclohexanone
FT-0771681
3,5-dimethyl-cyclohexanone
MFCD00019467
3,5-DiMethyl-d6-cyclohexanone--d4
CS-W013493
CHEBI:195509
D89827
7214-49-5
3,5-dimethylcyclohexan-1-one
FT-0634198
D1282
AKOS015917388
3,5-dimethylcyclo-hexanone
2320-30-1
1219804-55-3
NSC 21132
DTXSID30945879
EN300-72300
SCHEMBL339946
3,5-DIMETHYLCYCLOHEXANONE (MIXTURE OF ISOMERS)
3,5-dimethyl-1-cyclohexanone
3,5-Dimethyl-cyclohexanon
cis 3,5-dimethylcyclohexanone

MDL Number

MFCD00019467

FAQ

What is 3,5-Dimethylcyclohexanone (CAS: 2320-30-1)?

3,5-Dimethylcyclohexanone is a colorless to light yellow liquid with the CAS number 2320-30-1. It has a molecular formula of C9H14O and a molecular weight of 138.22. This compound is used as a solvent and intermediate in the synthesis of various organic compounds.

What are the main uses of 3,5-Dimethylcyclohexanone (CAS: 2320-30-1)?

3,5-Dimethylcyclohexanone is widely used as a solvent in the production of pharmaceuticals, dyes, and fragrances. It also serves as an intermediate in the synthesis of other organic compounds. Additionally, it is used in the manufacturing of resins and as a reagent in analytical chemistry.

Is 3,5-Dimethylcyclohexanone (CAS: 2320-30-1) safe?

3,5-Dimethylcyclohexanone is generally considered safe for industrial use, but it is important to follow safety guidelines. It is flammable and can cause irritation if inhaled or contacted with skin. Proper ventilation and personal protective equipment should be used when handling this compound.

How should 3,5-Dimethylcyclohexanone (CAS: 2320-30-1) be stored?

3,5-Dimethylcyclohexanone should be stored in a cool, well-ventilated area away from heat and sources of ignition. It should be kept in a tightly sealed container to prevent evaporation and contamination. Store it at a temperature not exceeding 25°C and avoid exposure to direct sunlight.