3,4-dimethyl 2-hydroxy-2-cyclopenten-1-one Structure

3,4-dimethyl 2-hydroxy-2-cyclopenten-1-one

Chemical Properties

Melting point 68-72 °C(lit.)
Boiling point 194.28°C (rough estimate)
Density  1.0579 (rough estimate)
refractive index  1.4690 (estimate)
FEMA  3268 | 3,4-DIMETHYL-1,2-CYCLOPENTADIONE
FLAVIS Number 07.075 | 3,4-Dimethylcyclopentan-1,2-dione
storage temp.  Inert atmosphere,2-8°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
Odor Type caramellic
biological source synthetic
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)
Substances Added to Food (formerly EAFUS) 3,4-DIMETHYL-1,2-CYCLOPENTADIONE
EWG's Food Scores 1
FDA UNII 50AIF51OCI
NIST Chemistry Reference 1,2-Cyclopentanedione, 3,4-dimethyl-(13494-06-9)
EPA Substance Registry System 1,2-Cyclopentanedione, 3,4-dimethyl- (13494-06-9)
UNSPSC Code 12164502
NACRES NA.21

Safety

Symbol(GHS) GHS hazard pictograms
Signal wordWarning
Hazard statements H302-H315-H319-H335
Precautionary statements P261-P305+P351+P338
Safety Statements  24/25
WGK Germany  3
TSCA  TSCA listed
HS Code  29142990
Storage Class 11 - Combustible Solids
NFPA 704:
0
1 0

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