ChemicalBook--->CAS DataBase List--->13494-06-9

13494-06-9

13494-06-9 Structure

13494-06-9 Structure
IdentificationMore
[Name]

3,4-Dimethyl-1,2-cyclopentanedione
[CAS]

13494-06-9
[Synonyms]

3,4-DIMETHYL-1,2-CYCLOPENTADIONE
3,4-DIMETHYL-1,2-CYCLOPENTANEDIONE
3,4-DIMETHYL-2-HYDROXY-2-CYCLOPENTENYL-1-ONE
FEMA 3268
METHYL CORYLONE
2-Cyclopentanedione,3,4-dimethyl-1
3,4-dimethyl-2-cyclopentanedione
3,4-dimethylcyclopentane-1,2-dione
2-hydroxy-3,4-dimethylcyclopent-2-en-1-one
3 4-DIMETHYL-1 2-CYCLOPENTADIONE 97+%
hydroxydimethylcyclopentenone,2-hydroxy-3,4-dimethyl-2-cyclopenten-1-one
1,2-Cyclopentanedione, 3,4-dimethyl-
2-HYDROXY-3,4-DIMETHYL-2-CYCLOPENTEN-1-ONE

2-hydroxy-3,4-dimethyl-2-cyclopenten-1-on
3,4-DIMETHYL-1,2-CYCLOPENTANEDIONE 97%
[EINECS(EC#)]

236-810-8
[Molecular Formula]

C7H10O2
[MDL Number]

MFCD00143063
[Molecular Weight]

126.15
[MOL File]

13494-06-9.mol
Chemical PropertiesBack Directory
[Appearance]

slightly yellow to light beige crystalline powder
[Melting point ]

68-72 °C(lit.)
[Boiling point ]

194.28°C (rough estimate)
[density ]

1.0579 (rough estimate)
[FEMA ]

3268
[refractive index ]

1.4690 (estimate)
[storage temp. ]

0-6°C
[solubility ]

Chloroform (Soluble), Methanol (Slightly)
[form ]

Crystalline Powder
[color ]

Slightly yellow to light beige
[Odor]

at 1.00 % in dipropylene glycol. sweet maple caramel sugar fenugreek licorice
[biological source]

synthetic
[Odor Type]

caramellic
[Water Solubility ]

slightly soluble
[JECFA Number]

420
[Major Application]

flavors and fragrances
[Cosmetics Ingredients Functions]

PERFUMING
[InChI]

1S/C7H10O2/c1-4-3-6(8)7(9)5(4)2/h4-5H,3H2,1-2H3
[InChIKey]

WGAVDEVFJDQIMZ-UHFFFAOYSA-N
[SMILES]

CC1CC(=O)C(=O)C1C
[LogP]

0.53
[CAS DataBase Reference]

13494-06-9(CAS DataBase Reference)
[NIST Chemistry Reference]

1,2-Cyclopentanedione, 3,4-dimethyl-(13494-06-9)
[EPA Substance Registry System]

13494-06-9(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[Safety Statements ]

S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

3
[TSCA ]

TSCA listed
[HS Code ]

29142990
[Storage Class]

11 - Combustible Solids
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

3,4-Dimethyl-1,2-cyclopentanedione(13494-06-9).msds
Hazard InformationBack Directory
[Chemical Properties]

slightly yellow to light beige crystalline powder
[Occurrence]

Reported found as a constituent in coffee.
[Uses]

3,4-Dimethyl-1,2-cyclopentanedione is a useful protective agent for food products.
[Preparation]

By alkylation of 3,5-dicarbetoxy-4-methyl-cyclopentane-1,2-dione followed by hydrolysis and decarboxylation of the resulting 3,5-dicarbetoxy-3,4-dimethyl-cyclopentane-1,2-di-one
[Aroma threshold values]

Detection: 17 to 20 ppb
[Taste threshold values]

Taste characteristics at 10 ppm: brown, sweet, sugary, maple and caramellic.
Spectrum DetailBack Directory
[Spectrum Detail]

3,4-dimethyl 2-hydroxy-2-cyclopenten-1-one(13494-06-9)1HNMR
3,4-dimethyl 2-hydroxy-2-cyclopenten-1-one(13494-06-9)FT-IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3,4-Dimethyl-1,2-cyclopentanedione, 97%(13494-06-9)
[Sigma Aldrich]

13494-06-9(sigmaaldrich)
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