4-(Dimethylamino)cyclohexanone

Basic Information

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CAS Number

40594-34-1

Molecular Formula

C8H15NO

Molecular Weight

141.21 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Physical Properties

Boiling Point

213.3℃ at 760 mmHg

Density

0.96

Flash Point

213.3 °C at 760 mmHg

Refractive Index

1.471

SMILES

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CN(C)C1CCC(=O)CC1

InChI

InChI=1S/C8H15NO/c1-9(2)7-3-5-8(10)6-4-7/h7H,3-6H2,1-2H3

InChIKey

LMBFUMXVHAJSNJ-UHFFFAOYSA-N

LogP

1.0596999999999999

Topological Polar Surface Area

20.310000000000002 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

121

Safety Information

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Hazard Class

Class 8 Class 8

Synonyms & References

English

AC-33805
SCHEMBL4272274
BCP03024
Cyclohexanone, 4-(dimethylamino)-
J-513726
CS-W003582
4-Dimethylamino-cyclohexanone
4-Dimethylaminocyclohexanone
GS-3735
AM85308
4-dimethylamino-1-cyclohexanone
4-(dimethylamino)cyclohexan-1-one
LMBFUMXVHAJSNJ-UHFFFAOYSA-N
AKOS006332098
MFCD09037892
DTXSID00438804
A6784
4-(dimethylamino)cyclohexanone
SB13838
SY017445
DIISOPROPYLPHOSPHORAMIDOUSDICHLORIDE
40594-34-1
EN300-156369
FT-0687599
4-(Dimethylamino)-cyclohexanone
4-(Dimethylamino)cyclohexanone
KSC583G9H
Cyclohexanone,4-(dimethylamino)-
CD0111

MDL Number

MFCD09037892

Customs Code

2922399090

FAQ

What is 4-(Dimethylamino)cyclohexanone (CAS: 40594-34-1)?

4-(Dimethylamino)cyclohexanone is a cyclohexanone derivative with the chemical formula C10H19NO. It is an odorless, colorless liquid with a slightly polar nature. This compound is used as a precursor in the synthesis of various pharmaceuticals and as a solvent in organic synthesis.

What are the main uses of 4-(Dimethylamino)cyclohexanone (CAS: 40594-34-1)?

4-(Dimethylamino)cyclohexanone is primarily used as an intermediate in the synthesis of pharmaceuticals, especially in the production of antipsychotic drugs. It also serves as a solvent in organic chemistry and is used in the preparation of other organic compounds.

Is 4-(Dimethylamino)cyclohexanone (CAS: 40594-34-1) safe?

4-(Dimethylamino)cyclohexanone can be considered safe when handled with appropriate precautions. It is mildly toxic by inhalation and ingestion, so it should be stored in a well-ventilated area and handled with gloves and protective eyewear. Avoid skin contact and inhalation of dust or fumes.

How should 4-(Dimethylamino)cyclohexanone (CAS: 40594-34-1) be stored?

4-(Dimethylamino)cyclohexanone should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a sealed container to prevent evaporation and contamination. Avoid storing it with strong acids or bases to prevent chemical reactions that could lead to hazards.