2-(1-Hydroxyethylidene)-5,5-dimethylcyclohexane-1,3-dione

Basic Information

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CAS Number

94142-97-9

Molecular Formula

C10H14O3

Molecular Weight

182.22 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Physical Properties

Physical State

Pale-yellow to Yellow-brown Solid

Melting Point

36-40 °C

SMILES

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CC(=O)C1=C(CC(CC1=O)(C)C)O

InChI

InChI=1S/C10H14O3/c1-6(11)9-7(12)4-10(2,3)5-8(9)13/h11H,4-5H2,1-3H3

InChIKey

INFBGIBBJNAITK-UHFFFAOYSA-N

LogP

1.7766

Topological Polar Surface Area

54.370000000000005 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

297

Safety Information

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Hazard Statement

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

1,3-Cyclohexanedione,2-(1-hydroxyethylidene)-5,5-dimethyl-
(4,4-DIMETHYL-2,6-DIOXOCYCLOHEXYLIDENE)ETHYL ALCOHOL
2-(1-Hydroxyethylidene)-5,5-dimethylcyclohexane-1,3-dione
2-Acetyldimedone(4,4-dimethyl-2,6-dioxocyclohexylidene)
DDE-OH
1-(4,4-dimethyl-2,6-dioxocyclohex-1-ylidene)ethanol
1,3-Cyclohexanedione,2-(1-hydroxyethylidene)-5,5-diMethyl
2-(1-HYDROXYETHYLIDENE)-5,5-DIMETHYL-1,3-CYCLOHEXANEDIONE
2,6-DICHLORO-3-FLUOROPHENACYL BROMIDE
2-acetyl-5,5'-dimethylcyclohexane-1,3-dione
2-ACETYLDIMEDONE
2-HYDROXYETHYL-5,5-DIMET
DDE
2-(1-Hydroxyethylidene)-5,5-dimethyl-1,3-cyclohexanedione (ACI)
DdeOH
SCHEMBL11609643
DTXSID00916293
(4,4-Dimethyl-2,6-dioxocyclohexylidene)ethyl alcohoc
1-Cyclohexen-3-one, 2-acetyl-1-hydroxy-5,5-dimethyl-
(4,4-dimethyl-2,6-dioxocyclohexylidene)ethyl alcohol
2-acetyldimedone(4,4-dimethyl-2,6-dioxocyclohexylidene)ethyl-dde
1-Hydroxyethylidene)-5,5-dimethyl-1,3-cyclohexanedione
94142-97-9
2-Acetyl-3-hydroxy-5,5-dimethyl-2-cyclohexen-1-one #
AC-14489
AKOS002236317
INFBGIBBJNAITK-UHFFFAOYSA-N
2-acetyl-3-hydroxy-5,5-dimethylcyclohex-2-en-1-one
MFCD03001669
2-(1-hydroxy-ethylidene)-5,5-dimethyl-cyclohexane-1,3-dione
AS-38344

MDL Number

MFCD03001669

Customs Code

2914400090

FAQ

What is 2-(1-Hydroxyethylidene)-5,5-dimethylcyclohexane-1,3-dione (CAS: 94142-97-9)?

2-(1-Hydroxyethylidene)-5,5-dimethylcyclohexane-1,3-dione is an organic compound with the CAS number 94142-97-9. It is a cyclic ketone that can be used in various applications due to its unique structural characteristics.

What are the main uses of 2-(1-Hydroxyethylidene)-5,5-dimethylcyclohexane-1,3-dione (CAS: 94142-97-9)?

2-(1-Hydroxyethylidene)-5,5-dimethylcyclohexane-1,3-dione is primarily used in pharmaceuticals and research as a precursor for the synthesis of other compounds. It is also utilized in the food industry as a food additive for its specific functional properties.

Is 2-(1-Hydroxyethylidene)-5,5-dimethylcyclohexane-1,3-dione (CAS: 94142-97-9) safe?

2-(1-Hydroxyethylidene)-5,5-dimethylcyclohexane-1,3-dione is generally considered safe for its intended uses. However, it is important to follow proper handling and safety guidelines to prevent exposure and ensure safe storage and use.

How should 2-(1-Hydroxyethylidene)-5,5-dimethylcyclohexane-1,3-dione (CAS: 94142-97-9) be stored?

2-(1-Hydroxyethylidene)-5,5-dimethylcyclohexane-1,3-dione should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly closed container to prevent moisture and contamination. Proper ventilation should be maintained during handling to avoid inhaling the compound.