1-Acetyladamantane

Basic Information

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CAS Number

1660-04-4

Molecular Formula

C12H18O

Molecular Weight

178.27 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

53-55 °C

Boiling Point

262.3°C at 760 mmHg

Water Solubility

Soluble in methanol- very faint turbidity. Insoluble in water.

Refractive Index

1.5050 (estimate)

SMILES

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CC(=O)C12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C12H18O/c1-8(13)12-5-9-2-10(6-12)4-11(3-9)7-12/h9-11H,2-7H2,1H3

InChIKey

DACIGVIOAFXPHW-UHFFFAOYSA-N

LogP

2.791800000000001

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

213

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

Acetyldamantane
SCHEMBL19757635
1-Adamantyl methyl ketone
Ethanone, 1-tricyclo(3.3.1.13,7)dec-1-yl-
DACIGVIOAFXPHW-CDECOKDKSA-N
Methyl 1-adamantyl ketone
1-Acetyladamantane
DACIGVIOAFXPHW-UHFFFAOYSA-
1-(tricyclo[3.3.1.13,7]dec-1-yl)ethanone
F1928-0002
adamantan-1-yl methyl ketone
AKOS000423113
Ethanone,1-tricyclo[3.3.1.13,7]dec-1-yl-
AKOS000121013
Methyl tricyclo(3.3.1.13,7)dec-1-yl ketone
FT-0633741
InChI=1/C12H18O/c1-8(13)12-5-9-2-10(6-12)4-11(3-9)7-12/h9-11H,2-7H2,1H3
1-(1-Adamantyl)ethanone
MFCD00074739
1-(1-adamantyl)ethan-1-one
Methyl adamantyl ketone
DTXSID60168059
1-((3r,5r,7r)-adamantan-1-yl)ethan-1-one
SY023641
VU0494587-1
adamantan-1-yl-ethan-1-one
NS00025431
1-Adamantyl methyl ketone, 99%
1660-04-4
1-Acetyl-adamantane
Ethanone, 1-tricyclo[3.3.1.1(3,7)-]dec-1-yl-

MDL Number

MFCD00074739

Customs Code

2914299000

FAQ

What is 1-Acetyladamantane (CAS: 1660-04-4)?

1-Acetyladamantane is an organic compound with the CAS number 1660-04-4. It is a derivative of adamantane with an acetyl group attached to the nitrogen atom in the central ring. This compound is known for its unique physical and chemical properties, including its stability and potential for use in various applications.

What are the main uses of 1-Acetyladamantane (CAS: 1660-04-4)?

1-Acetyladamantane (CAS: 1660-04-4) is primarily used in pharmaceuticals for its potential as a precursor in medicinal chemistry and as a research tool. It can also be utilized in materials science due to its unique structural features and stability.

Is 1-Acetyladamantane (CAS: 1660-04-4) safe?

1-Acetyladamantane (CAS: 1660-04-4) is generally considered safe when handled properly. However, it is important to follow all safety guidelines, including the use of appropriate personal protective equipment (PPE) and ensuring proper ventilation during handling. Avoid contact with eyes and skin, and dispose of waste materials according to local regulations.

How should 1-Acetyladamantane (CAS: 1660-04-4) be stored?

1-Acetyladamantane (CAS: 1660-04-4) should be stored in a cool, dry place away from direct sunlight and heat sources. It is recommended to store it in a tightly sealed container to prevent contamination and degradation. Ensure that the storage area is well-ventilated and that access is restricted to authorized personnel only.